4-(3-methoxyphenyl)-N-(2-methoxy-5-phenyl-phenyl)piperazine-1-carbothioamide

Systemtic Name: 4-(3-methoxyphenyl)-N-(2-methoxy-5-phenyl-phenyl)piperazine-1-carbothioamide Openeye Name: 4-(3-methoxyphenyl)-N-(2-methoxy-5-phenyl-phenyl)piperazine-1-carbothioamide CAS Name: 4-(3-methoxyphenyl)-N-(2-methoxy-5-phenylphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-(3-methoxyphenyl)-N-(2-methoxy-5-phenylphenyl)piperazine-1-carbothioamide Traditional Name: 4-(3-methoxyphenyl)-N-(2-methoxy-5-phenyl-phenyl)piperazine-1-carbothioamide Formula: C25H27N3O2S MolecularWeight: 433.56578

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC=CC=C2)NC(=S)N3CCN(CC3)C4=CC(=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC=CC=C2)NC(=S)N3CCN(CC3)C4=CC(=CC=C4)OC

InChI

InChI=1S/C25H27N3O2S/c1-29-22-10-6-9-21(18-22)27-13-15-28(16-14-27)25(31)26-23-17-20(11-12-24(23)30-2)19-7-4-3-5-8-19/h3-12,17-18H,13-16H2,1-2H3,(H,26,31)