N-(4-ethoxyphenyl)-4-[(2-methylphenyl)methyl]piperazine-1-carbothioamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)N2CCN(CC2)CC3=CC=CC=C3C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)N2CCN(CC2)CC3=CC=CC=C3C

InChI

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