N-[2-(4-chlorophenyl)ethyl]-4-(4-methoxyphenyl)-3-methyl-piperazine-1-carbothioamide

Systemtic Name: N-[2-(4-chlorophenyl)ethyl]-4-(4-methoxyphenyl)-3-methyl-piperazine-1-carbothioamide Openeye Name: N-[2-(4-chlorophenyl)ethyl]-4-(4-methoxyphenyl)-3-methyl-piperazine-1-carbothioamide CAS Name: N-[2-(4-chlorophenyl)ethyl]-4-(4-methoxyphenyl)-3-methyl-1-piperazinecarbothioamide IUPAC Name: N-[2-(4-chlorophenyl)ethyl]-4-(4-methoxyphenyl)-3-methylpiperazine-1-carbothioamide Traditional Name: N-[2-(4-chlorophenyl)ethyl]-4-(4-methoxyphenyl)-3-methyl-piperazine-1-carbothioamide Formula: C21H26ClN3OS MolecularWeight: 403.96864

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=CC=C(C=C2)OC)C(=S)NCCC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1CN(CCN1C2=CC=C(C=C2)OC)C(=S)NCCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H26ClN3OS/c1-16-15-24(13-14-25(16)19-7-9-20(26-2)10-8-19)21(27)23-12-11-17-3-5-18(22)6-4-17/h3-10,16H,11-15H2,1-2H3,(H,23,27)