CHEBI:116987 - 5-[1-[(2-chlorophenyl)methyl]-2,5-dimethyl-3-pyrrolyl]-N-(1-methoxypropan-2-yl)-6H-1,3,4-thiadiazin-2-amine

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ChEBI Name 5-[1-[(2-chlorophenyl)methyl]-2,5-dimethyl-3-pyrrolyl]-N-(1-methoxypropan-2-yl)-6H-1,3,4-thiadiazin-2-amine
ChEBI ID CHEBI:116987
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C20H25ClN4OS
Net Charge 0
Average Mass 404.958
Monoisotopic Mass 404.14376
InChI InChI=1S/C20H25ClN4OS/c1-13(11-26-4)22-20-24-23-19(12-27-20)17-9-14(2)25(15(17)3)10-16-7-5-6-8-18(16)21/h5-9,13H,10-12H2,1-4H3,(H,22,24)
InChIKey VERXCDZMLMBGMO-UHFFFAOYSA-N
SMILES CC1=CC(=C(N1CC2=CC=CC=C2Cl)C)C3=NN=C(SC3)NC(C)COC
ChEBI Ontology
Outgoing 5-[1-[(2-chlorophenyl)methyl]-2,5-dimethyl-3-pyrrolyl]-N-(1-methoxypropan-2-yl)-6H-1,3,4-thiadiazin-2-amine (CHEBI:116987) is a organochlorine compound (CHEBI:36683)
Manual Xref Database
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