[2,3-dimethyl-1-(phenylmethyl)indol-5-yl]-[4-(pyridin-3-ylmethyl)piperazin-1-yl]methanone

Systemtic Name: [2,3-dimethyl-1-(phenylmethyl)indol-5-yl]-[4-(pyridin-3-ylmethyl)piperazin-1-yl]methanone Openeye Name: (1-benzyl-2,3-dimethyl-indol-5-yl)-[4-(3-pyridylmethyl)piperazin-1-yl]methanone CAS Name: [2,3-dimethyl-1-(phenylmethyl)-5-indolyl]-[4-(3-pyridinylmethyl)-1-piperazinyl]methanone IUPAC Name: (1-benzyl-2,3-dimethylindol-5-yl)-[4-(pyridin-3-ylmethyl)piperazin-1-yl]methanone Traditional Name: (1-benzyl-2,3-dimethyl-indol-5-yl)-[4-(3-pyridylmethyl)piperazino]methanone Formula: C28H30N4O MolecularWeight: 438.564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=C1C=C(C=C2)C(=O)N3CCN(CC3)CC4=CN=CC=C4)CC5=CC=CC=C5)C

Isomeric SMILES

CC1=C(N(C2=C1C=C(C=C2)C(=O)N3CCN(CC3)CC4=CN=CC=C4)CC5=CC=CC=C5)C

InChI

InChI=1S/C28H30N4O/c1-21-22(2)32(20-23-7-4-3-5-8-23)27-11-10-25(17-26(21)27)28(33)31-15-13-30(14-16-31)19-24-9-6-12-29-18-24/h3-12,17-18H,13-16,19-20H2,1-2H3