N-(2-methoxy-5-methyl-phenyl)-4-(1-phenylethyl)piperazine-1-carbothioamide

Systemtic Name: N-(2-methoxy-5-methyl-phenyl)-4-(1-phenylethyl)piperazine-1-carbothioamide Openeye Name: N-(2-methoxy-5-methyl-phenyl)-4-(1-phenylethyl)piperazine-1-carbothioamide CAS Name: N-(2-methoxy-5-methylphenyl)-4-(1-phenylethyl)-1-piperazinecarbothioamide IUPAC Name: N-(2-methoxy-5-methylphenyl)-4-(1-phenylethyl)piperazine-1-carbothioamide Traditional Name: N-(2-methoxy-5-methyl-phenyl)-4-(1-phenylethyl)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)C(C)C3=CC=CC=C3

Isomeric SMILES

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

InChI

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