CHEBI:117901 - N-[[(2S,4R)-4-[(4-methyl-5-isoquinolinyl)sulfonylamino]-2-pyrrolidinyl]methyl]acetamide

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ChEBI Name N-[[(2S,4R)-4-[(4-methyl-5-isoquinolinyl)sulfonylamino]-2-pyrrolidinyl]methyl]acetamide
ChEBI ID CHEBI:117901
Stars This entity has been manually annotated by a third party.
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Formula C17H22N4O3S
Net Charge 0
Average Mass 362.448
Monoisotopic Mass 362.14126
InChI InChI=1S/C17H22N4O3S/c1-11-7-18-8-13-4-3-5-16(17(11)13)25(23,24)21-15-6-14(20-10-15)9-19-12(2)22/h3-5,7-8,14-15,20-21H,6,9-10H2,1-2H3,(H,19,22)/t14-,15+/m0/s1
InChIKey KAAADIFKRHNJHA-LSDHHAIUSA-N
SMILES CC1=C2C(=CN=C1)C=CC=C2S(=O)(=O)N[C@@H]3C[C@H](NC3)CNC(=O)C
ChEBI Ontology
Outgoing N-[[(2S,4R)-4-[(4-methyl-5-isoquinolinyl)sulfonylamino]-2-pyrrolidinyl]methyl]acetamide (CHEBI:117901) is a isoquinolines (CHEBI:24922)
Manual Xref Database
LSM-29350 LINCS
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