(1,5-dimethyl-2-phenyl-indol-3-yl)-[4-(5-methoxypyridin-2-yl)-1,4-diazepan-1-yl]methanone

Systemtic Name: (1,5-dimethyl-2-phenyl-indol-3-yl)-[4-(5-methoxypyridin-2-yl)-1,4-diazepan-1-yl]methanone Openeye Name: (1,5-dimethyl-2-phenyl-indol-3-yl)-[4-(5-methoxy-2-pyridyl)-1,4-diazepan-1-yl]methanone CAS Name: (1,5-dimethyl-2-phenyl-3-indolyl)-[4-(5-methoxy-2-pyridinyl)-1,4-diazepan-1-yl]methanone IUPAC Name: (1,5-dimethyl-2-phenylindol-3-yl)-[4-(5-methoxypyridin-2-yl)-1,4-diazepan-1-yl]methanone Traditional Name: (1,5-dimethyl-2-phenyl-indol-3-yl)-[4-(5-methoxy-2-pyridyl)-1,4-diazepan-1-yl]methanone Formula: C28H30N4O2 MolecularWeight: 454.5634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=C2C(=O)N3CCCN(CC3)C4=NC=C(C=C4)OC)C5=CC=CC=C5)C

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=C2C(=O)N3CCCN(CC3)C4=NC=C(C=C4)OC)C5=CC=CC=C5)C

InChI

InChI=1S/C28H30N4O2/c1-20-10-12-24-23(18-20)26(27(30(24)2)21-8-5-4-6-9-21)28(33)32-15-7-14-31(16-17-32)25-13-11-22(34-3)19-29-25/h4-6,8-13,18-19H,7,14-17H2,1-3H3