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

Systemtic Name: [2-(3-methoxyphenyl)-1,5-dimethyl-indol-3-yl]-(4-pyridin-2-yl-1,4-diazepan-1-yl)methanone Openeye Name: [2-(3-methoxyphenyl)-1,5-dimethyl-indol-3-yl]-[4-(2-pyridyl)-1,4-diazepan-1-yl]methanone CAS Name: [2-(3-methoxyphenyl)-1,5-dimethyl-3-indolyl]-[4-(2-pyridinyl)-1,4-diazepan-1-yl]methanone IUPAC Name: [2-(3-methoxyphenyl)-1,5-dimethylindol-3-yl]-(4-pyridin-2-yl-1,4-diazepan-1-yl)methanone Traditional Name: [2-(3-methoxyphenyl)-1,5-dimethyl-indol-3-yl]-[4-(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=CC=CC=N4)C5=CC(=CC=C5)OC)C

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=C2C(=O)N3CCCN(CC3)C4=CC=CC=N4)C5=CC(=CC=C5)OC)C

InChI

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