CHEBI:107360 - N-[[4-(4-morpholinylmethyl)anilino]-sulfanylidenemethyl]-3-(3-nitrophenyl)-2-propenamide

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name N-[[4-(4-morpholinylmethyl)anilino]-sulfanylidenemethyl]-3-(3-nitrophenyl)-2-propenamide
ChEBI ID CHEBI:107360
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C21H22N4O4S
Net Charge 0
Average Mass 426.491
Monoisotopic Mass 426.13618
InChI InChI=1S/C21H22N4O4S/c26-20(9-6-16-2-1-3-19(14-16)25(27)28)23-21(30)22-18-7-4-17(5-8-18)15-24-10-12-29-13-11-24/h1-9,14H,10-13,15H2,(H2,22,23,26,30)
InChIKey JDZIERLOPXSINW-UHFFFAOYSA-N
SMILES C1COCCN1CC2=CC=C(C=C2)NC(=S)NC(=O)C=CC3=CC(=CC=C3)[N+](=O)[O-]
ChEBI Ontology
Outgoing N-[[4-(4-morpholinylmethyl)anilino]-sulfanylidenemethyl]-3-(3-nitrophenyl)-2-propenamide (CHEBI:107360) is a thioureas (CHEBI:51276)
Manual Xref Database
LSM-18714 LINCS
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