(1-methyl-2-phenyl-5-propan-2-yl-indol-3-yl)-(4-pyridin-2-yl-1,4-diazepan-1-yl)methanone hydrochloride

Systemtic Name: (1-methyl-2-phenyl-5-propan-2-yl-indol-3-yl)-(4-pyridin-2-yl-1,4-diazepan-1-yl)methanone hydrochloride Openeye Name: (5-isopropyl-1-methyl-2-phenyl-indol-3-yl)-[4-(2-pyridyl)-1,4-diazepan-1-yl]methanone hydrochloride CAS Name: (1-methyl-2-phenyl-5-propan-2-yl-3-indolyl)-[4-(2-pyridinyl)-1,4-diazepan-1-yl]methanone hydrochloride IUPAC Name: (1-methyl-2-phenyl-5-propan-2-ylindol-3-yl)-(4-pyridin-2-yl-1,4-diazepan-1-yl)methanone hydrochloride Traditional Name: (5-isopropyl-1-methyl-2-phenyl-indol-3-yl)-[4-(2-pyridyl)-1,4-diazepan-1-yl]methanone hydrochloride Formula: C29H33ClN4O MolecularWeight: 489.05152

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=C(C=C1)N(C(=C2C(=O)N3CCCN(CC3)C4=CC=CC=N4)C5=CC=CC=C5)C.Cl

Isomeric SMILES

CC(C)C1=CC2=C(C=C1)N(C(=C2C(=O)N3CCCN(CC3)C4=CC=CC=N4)C5=CC=CC=C5)C.Cl

InChI

InChI=1S/C29H32N4O.ClH/c1-21(2)23-13-14-25-24(20-23)27(28(31(25)3)22-10-5-4-6-11-22)29(34)33-17-9-16-32(18-19-33)26-12-7-8-15-30-26;/h4-8,10-15,20-21H,9,16-19H2,1-3H3;1H