3-(phenylmethyl)-1-(2-piperazin-2-ylpropanoyl)-2-piperidin-1-yl-indole-5-carboxamide

Systemtic Name: 3-(phenylmethyl)-1-(2-piperazin-2-ylpropanoyl)-2-piperidin-1-yl-indole-5-carboxamide Openeye Name: 3-benzyl-1-(2-piperazin-2-ylpropanoyl)-2-(1-piperidyl)indole-5-carboxamide CAS Name: 1-[1-oxo-2-(2-piperazinyl)propyl]-3-(phenylmethyl)-2-(1-piperidinyl)-5-indolecarboxamide IUPAC Name: 3-benzyl-1-(2-piperazin-2-ylpropanoyl)-2-piperidin-1-ylindole-5-carboxamide Traditional Name: 3-benzyl-1-(2-piperazin-2-ylpropanoyl)-2-piperidino-indole-5-carboxamide Formula: C28H35N5O2 MolecularWeight: 473.6098

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CNCCN1)C(=O)N2C3=C(C=C(C=C3)C(=O)N)C(=C2N4CCCCC4)CC5=CC=CC=C5

Isomeric SMILES

CC(C1CNCCN1)C(=O)N2C3=C(C=C(C=C3)C(=O)N)C(=C2N4CCCCC4)CC5=CC=CC=C5

InChI

InChI=1S/C28H35N5O2/c1-19(24-18-30-12-13-31-24)28(35)33-25-11-10-21(26(29)34)17-22(25)23(16-20-8-4-2-5-9-20)27(33)32-14-6-3-7-15-32/h2,4-5,8-11,17,19,24,30-31H,3,6-7,12-16,18H2,1H3,(H2,29,34)