N-(2-methoxy-5-methyl-phenyl)-4-[(2-methylphenyl)methyl]piperazine-1-carbothioamide

Systemtic Name: N-(2-methoxy-5-methyl-phenyl)-4-[(2-methylphenyl)methyl]piperazine-1-carbothioamide Openeye Name: N-(2-methoxy-5-methyl-phenyl)-4-(o-tolylmethyl)piperazine-1-carbothioamide CAS Name: N-(2-methoxy-5-methylphenyl)-4-[(2-methylphenyl)methyl]-1-piperazinecarbothioamide IUPAC Name: N-(2-methoxy-5-methylphenyl)-4-[(2-methylphenyl)methyl]piperazine-1-carbothioamide Traditional Name: N-(2-methoxy-5-methyl-phenyl)-4-(2-methylbenzyl)piperazine-1-carbothioamide Formula: C21H27N3OS MolecularWeight: 369.52358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=S)N2CCN(CC2)CC3=CC=CC=C3C

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=S)N2CCN(CC2)CC3=CC=CC=C3C

InChI

InChI=1S/C21H27N3OS/c1-16-8-9-20(25-3)19(14-16)22-21(26)24-12-10-23(11-13-24)15-18-7-5-4-6-17(18)2/h4-9,14H,10-13,15H2,1-3H3,(H,22,26)