N-(3-cyclopentyloxy-4-methoxy-phenyl)-4-(2-methylsulfanylphenyl)piperazine-1-carboxamide

Systemtic Name: N-(3-cyclopentyloxy-4-methoxy-phenyl)-4-(2-methylsulfanylphenyl)piperazine-1-carboxamide Openeye Name: N-[3-(cyclopentoxy)-4-methoxy-phenyl]-4-(2-methylsulfanylphenyl)piperazine-1-carboxamide CAS Name: N-(3-cyclopentyloxy-4-methoxyphenyl)-4-[2-(methylthio)phenyl]-1-piperazinecarboxamide IUPAC Name: N-(3-cyclopentyloxy-4-methoxyphenyl)-4-(2-methylsulfanylphenyl)piperazine-1-carboxamide Traditional Name: N-[3-(cyclopentoxy)-4-methoxy-phenyl]-4-[2-(methylthio)phenyl]piperazine-1-carboxamide Formula: C24H31N3O3S MolecularWeight: 441.58624

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)N2CCN(CC2)C3=CC=CC=C3SC)OC4CCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)N2CCN(CC2)C3=CC=CC=C3SC)OC4CCCC4

InChI

InChI=1S/C24H31N3O3S/c1-29-21-12-11-18(17-22(21)30-19-7-3-4-8-19)25-24(28)27-15-13-26(14-16-27)20-9-5-6-10-23(20)31-2/h5-6,9-12,17,19H,3-4,7-8,13-16H2,1-2H3,(H,25,28)