2,3-dimethyl-N-[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]-1H-indole-5-carboxamide

Systemtic Name: 2,3-dimethyl-N-[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]-1H-indole-5-carboxamide Openeye Name: N-[4-(4-benzylpiperazin-1-yl)phenyl]-2,3-dimethyl-1H-indole-5-carboxamide CAS Name: 2,3-dimethyl-N-[4-[4-(phenylmethyl)-1-piperazinyl]phenyl]-1H-indole-5-carboxamide IUPAC Name: N-[4-(4-benzylpiperazin-1-yl)phenyl]-2,3-dimethyl-1H-indole-5-carboxamide Traditional Name: N-[4-(4-benzylpiperazino)phenyl]-2,3-dimethyl-1H-indole-5-carboxamide Formula: C28H30N4O MolecularWeight: 438.564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC2=C1C=C(C=C2)C(=O)NC3=CC=C(C=C3)N4CCN(CC4)CC5=CC=CC=C5)C

Isomeric SMILES

CC1=C(NC2=C1C=C(C=C2)C(=O)NC3=CC=C(C=C3)N4CCN(CC4)CC5=CC=CC=C5)C

InChI

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