1-[2-(butylamino)-2-oxidanylidene-ethyl]-2-[4-(phenylmethyl)piperidin-1-yl]indole-5-carboxamide

Systemtic Name: 1-[2-(butylamino)-2-oxidanylidene-ethyl]-2-[4-(phenylmethyl)piperidin-1-yl]indole-5-carboxamide Openeye Name: 2-(4-benzyl-1-piperidyl)-1-[2-(butylamino)-2-oxo-ethyl]indole-5-carboxamide CAS Name: 1-[2-(butylamino)-2-oxoethyl]-2-[4-(phenylmethyl)-1-piperidinyl]-5-indolecarboxamide IUPAC Name: 2-(4-benzylpiperidin-1-yl)-1-[2-(butylamino)-2-oxoethyl]indole-5-carboxamide Traditional Name: 2-(4-benzylpiperidino)-1-[2-(butylamino)-2-keto-ethyl]indole-5-carboxamide Formula: C27H34N4O2 MolecularWeight: 446.58446

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CN1C2=C(C=C(C=C2)C(=O)N)C=C1N3CCC(CC3)CC4=CC=CC=C4

Isomeric SMILES

CCCCNC(=O)CN1C2=C(C=C(C=C2)C(=O)N)C=C1N3CCC(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C27H34N4O2/c1-2-3-13-29-25(32)19-31-24-10-9-22(27(28)33)17-23(24)18-26(31)30-14-11-21(12-15-30)16-20-7-5-4-6-8-20/h4-10,17-18,21H,2-3,11-16,19H2,1H3,(H2,28,33)(H,29,32)