N-[4-(4-ethylpiperazin-1-yl)-3-methyl-phenyl]-1-(4-methylphenyl)carbonyl-piperidine-3-carboxamide

Systemtic Name: N-[4-(4-ethylpiperazin-1-yl)-3-methyl-phenyl]-1-(4-methylphenyl)carbonyl-piperidine-3-carboxamide Openeye Name: N-[4-(4-ethylpiperazin-1-yl)-3-methyl-phenyl]-1-(4-methylbenzoyl)piperidine-3-carboxamide CAS Name: N-[4-(4-ethyl-1-piperazinyl)-3-methylphenyl]-1-[(4-methylphenyl)-oxomethyl]-3-piperidinecarboxamide IUPAC Name: N-[4-(4-ethylpiperazin-1-yl)-3-methylphenyl]-1-(4-methylbenzoyl)piperidine-3-carboxamide Traditional Name: N-[4-(4-ethylpiperazino)-3-methyl-phenyl]-1-p-toluoyl-nipecotamide Formula: C27H36N4O2 MolecularWeight: 448.60034

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3CCCN(C3)C(=O)C4=CC=C(C=C4)C)C

Isomeric SMILES

CCN1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3CCCN(C3)C(=O)C4=CC=C(C=C4)C)C

InChI

InChI=1S/C27H36N4O2/c1-4-29-14-16-30(17-15-29)25-12-11-24(18-21(25)3)28-26(32)23-6-5-13-31(19-23)27(33)22-9-7-20(2)8-10-22/h7-12,18,23H,4-6,13-17,19H2,1-3H3,(H,28,32)