(3S)-N-(6-chloranyl-9H-pyrido[3,4-b]indol-8-yl)-6,6-dimethyl-4-[(2S)-3-methyl-2-[(2-methylpyridin-3-yl)carbonylamino]butyl]morpholine-3-carboxamide

Systemtic Name: (3S)-N-(6-chloranyl-9H-pyrido[3,4-b]indol-8-yl)-6,6-dimethyl-4-[(2S)-3-methyl-2-[(2-methylpyridin-3-yl)carbonylamino]butyl]morpholine-3-carboxamide Openeye Name: (3S)-N-(6-chloro-9H-pyrido[3,4-b]indol-8-yl)-6,6-dimethyl-4-[(2S)-3-methyl-2-[(2-methylpyridine-3-carbonyl)amino]butyl]morpholine-3-carboxamide CAS Name: (3S)-N-(6-chloro-9H-pyrido[3,4-b]indol-8-yl)-6,6-dimethyl-4-[(2S)-3-methyl-2-[[(2-methyl-3-pyridinyl)-oxomethyl]amino]butyl]-3-morpholinecarboxamide IUPAC Name: (3S)-N-(6-chloro-9H-pyrido[3,4-b]indol-8-yl)-6,6-dimethyl-4-[(2S)-3-methyl-2-[(2-methylpyridine-3-carbonyl)amino]butyl]morpholine-3-carboxamide Traditional Name: (3S)-N-(6-chloro-9H-$b-carbolin-8-yl)-6,6-dimethyl-4-[(2S)-3-methyl-2-[(2-methylnicotinoyl)amino]butyl]morpholine-3-carboxamide Formula: C30H35ClN6O3 MolecularWeight: 563.0903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=N1)C(=O)NC(CN2CC(OCC2C(=O)NC3=C4C(=CC(=C3)Cl)C5=C(N4)C=NC=C5)(C)C)C(C)C

Isomeric SMILES

CC1=C(C=CC=N1)C(=O)N[C@H](CN2CC(OC[C@H]2C(=O)NC3=C4C(=CC(=C3)Cl)C5=C(N4)C=NC=C5)(C)C)C(C)C

InChI

InChI=1S/C30H35ClN6O3/c1-17(2)25(36-28(38)20-7-6-9-33-18(20)3)14-37-16-30(4,5)40-15-26(37)29(39)35-23-12-19(31)11-22-21-8-10-32-13-24(21)34-27(22)23/h6-13,17,25-26,34H,14-16H2,1-5H3,(H,35,39)(H,36,38)/t25-,26+/m1/s1