N-(2,6-diethylphenyl)-4-(2-methylsulfanylphenyl)piperazine-1-carboxamide

Systemtic Name: N-(2,6-diethylphenyl)-4-(2-methylsulfanylphenyl)piperazine-1-carboxamide Openeye Name: N-(2,6-diethylphenyl)-4-(2-methylsulfanylphenyl)piperazine-1-carboxamide CAS Name: N-(2,6-diethylphenyl)-4-[2-(methylthio)phenyl]-1-piperazinecarboxamide IUPAC Name: N-(2,6-diethylphenyl)-4-(2-methylsulfanylphenyl)piperazine-1-carboxamide Traditional Name: N-(2,6-diethylphenyl)-4-[2-(methylthio)phenyl]piperazine-1-carboxamide Formula: C22H29N3OS MolecularWeight: 383.55016

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)N2CCN(CC2)C3=CC=CC=C3SC

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)N2CCN(CC2)C3=CC=CC=C3SC

InChI

InChI=1S/C22H29N3OS/c1-4-17-9-8-10-18(5-2)21(17)23-22(26)25-15-13-24(14-16-25)19-11-6-7-12-20(19)27-3/h6-12H,4-5,13-16H2,1-3H3,(H,23,26)