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

Systemtic Name: N-(6-chloranyl-9H-pyrido[3,4-b]indol-8-yl)-6,6-dimethyl-4-[(2S)-2-[(2-methylpyridin-3-yl)carbonylamino]propyl]morpholine-3-carboxamide Openeye Name: N-(6-chloro-9H-pyrido[3,4-b]indol-8-yl)-6,6-dimethyl-4-[(2S)-2-[(2-methylpyridine-3-carbonyl)amino]propyl]morpholine-3-carboxamide CAS Name: N-(6-chloro-9H-pyrido[3,4-b]indol-8-yl)-6,6-dimethyl-4-[(2S)-2-[[(2-methyl-3-pyridinyl)-oxomethyl]amino]propyl]-3-morpholinecarboxamide IUPAC Name: N-(6-chloro-9H-pyrido[3,4-b]indol-8-yl)-6,6-dimethyl-4-[(2S)-2-[(2-methylpyridine-3-carbonyl)amino]propyl]morpholine-3-carboxamide Traditional Name: N-(6-chloro-9H-$b-carbolin-8-yl)-6,6-dimethyl-4-[(2S)-2-[(2-methylnicotinoyl)amino]propyl]morpholine-3-carboxamide Formula: C28H31ClN6O3 MolecularWeight: 535.03714

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=C(C=CC=N1)C(=O)N[C@@H](C)CN2CC(OCC2C(=O)NC3=C4C(=CC(=C3)Cl)C5=C(N4)C=NC=C5)(C)C

InChI

InChI=1S/C28H31ClN6O3/c1-16(32-26(36)19-6-5-8-31-17(19)2)13-35-15-28(3,4)38-14-24(35)27(37)34-22-11-18(29)10-21-20-7-9-30-12-23(20)33-25(21)22/h5-12,16,24,33H,13-15H2,1-4H3,(H,32,36)(H,34,37)/t16-,24?/m0/s1