N-[1-(1-azanyl-3-oxidanyl-pyrrolidin-2-yl)-4-methyl-1-oxidanylidene-pentan-2-yl]isoquinoline-3-carboxamide

Systemtic Name: N-[1-(1-azanyl-3-oxidanyl-pyrrolidin-2-yl)-4-methyl-1-oxidanylidene-pentan-2-yl]isoquinoline-3-carboxamide Openeye Name: N-[1-(1-amino-3-hydroxy-pyrrolidine-2-carbonyl)-3-methyl-butyl]isoquinoline-3-carboxamide CAS Name: N-[1-(1-amino-3-hydroxy-2-pyrrolidinyl)-4-methyl-1-oxopentan-2-yl]-3-isoquinolinecarboxamide IUPAC Name: N-[1-(1-amino-3-hydroxypyrrolidin-2-yl)-4-methyl-1-oxopentan-2-yl]isoquinoline-3-carboxamide Traditional Name: N-[1-(1-amino-3-hydroxy-prolyl)-3-methyl-butyl]isoquinoline-3-carboxamide Formula: C20H26N4O3 MolecularWeight: 370.44544

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)C1C(CCN1N)O)NC(=O)C2=CC3=CC=CC=C3C=N2

Isomeric SMILES

CC(C)CC(C(=O)C1C(CCN1N)O)NC(=O)C2=CC3=CC=CC=C3C=N2

InChI

InChI=1S/C20H26N4O3/c1-12(2)9-15(19(26)18-17(25)7-8-24(18)21)23-20(27)16-10-13-5-3-4-6-14(13)11-22-16/h3-6,10-12,15,17-18,25H,7-9,21H2,1-2H3,(H,23,27)