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

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

Isomeric SMILES

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

InChI

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