4-(2-methoxyphenyl)-N-(2,4,6-trimethylphenyl)piperazine-1-carbothioamide

Systemtic Name: 4-(2-methoxyphenyl)-N-(2,4,6-trimethylphenyl)piperazine-1-carbothioamide Openeye Name: 4-(2-methoxyphenyl)-N-(2,4,6-trimethylphenyl)piperazine-1-carbothioamide CAS Name: 4-(2-methoxyphenyl)-N-(2,4,6-trimethylphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-(2-methoxyphenyl)-N-(2,4,6-trimethylphenyl)piperazine-1-carbothioamide Traditional Name: N-mesityl-4-(2-methoxyphenyl)piperazine-1-carbothioamide Formula: C21H27N3OS MolecularWeight: 369.52358

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=S)N2CCN(CC2)C3=CC=CC=C3OC)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=S)N2CCN(CC2)C3=CC=CC=C3OC)C

InChI

InChI=1S/C21H27N3OS/c1-15-13-16(2)20(17(3)14-15)22-21(26)24-11-9-23(10-12-24)18-7-5-6-8-19(18)25-4/h5-8,13-14H,9-12H2,1-4H3,(H,22,26)