4-(1,5-dimethyl-2-phenyl-indol-3-yl)carbonyl-N-(3-oxidanylpropyl)-2-piperazin-1-yl-pyridine-3-carboxamide

Systemtic Name: 4-(1,5-dimethyl-2-phenyl-indol-3-yl)carbonyl-N-(3-oxidanylpropyl)-2-piperazin-1-yl-pyridine-3-carboxamide Openeye Name: 4-(1,5-dimethyl-2-phenyl-indole-3-carbonyl)-N-(3-hydroxypropyl)-2-piperazin-1-yl-pyridine-3-carboxamide CAS Name: 4-[(1,5-dimethyl-2-phenyl-3-indolyl)-oxomethyl]-N-(3-hydroxypropyl)-2-(1-piperazinyl)-3-pyridinecarboxamide IUPAC Name: 4-(1,5-dimethyl-2-phenylindole-3-carbonyl)-N-(3-hydroxypropyl)-2-piperazin-1-ylpyridine-3-carboxamide Traditional Name: 4-(1,5-dimethyl-2-phenyl-indole-3-carbonyl)-N-(3-hydroxypropyl)-2-piperazino-nicotinamide Formula: C30H33N5O3 MolecularWeight: 511.61472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=C2C(=O)C3=C(C(=NC=C3)N4CCNCC4)C(=O)NCCCO)C5=CC=CC=C5)C

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=C2C(=O)C3=C(C(=NC=C3)N4CCNCC4)C(=O)NCCCO)C5=CC=CC=C5)C

InChI

InChI=1S/C30H33N5O3/c1-20-9-10-24-23(19-20)25(27(34(24)2)21-7-4-3-5-8-21)28(37)22-11-13-32-29(35-16-14-31-15-17-35)26(22)30(38)33-12-6-18-36/h3-5,7-11,13,19,31,36H,6,12,14-18H2,1-2H3,(H,33,38)