N-(2-methylphenyl)-4-(thiophen-3-ylmethyl)piperazine-1-carbothioamide

Systemtic Name: N-(2-methylphenyl)-4-(thiophen-3-ylmethyl)piperazine-1-carbothioamide Openeye Name: N-(o-tolyl)-4-(3-thienylmethyl)piperazine-1-carbothioamide CAS Name: N-(2-methylphenyl)-4-(3-thiophenylmethyl)-1-piperazinecarbothioamide IUPAC Name: N-(2-methylphenyl)-4-(thiophen-3-ylmethyl)piperazine-1-carbothioamide Traditional Name: N-(o-tolyl)-4-(3-thenyl)piperazine-1-carbothioamide Formula: C17H21N3S2 MolecularWeight: 331.49874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=S)N2CCN(CC2)CC3=CSC=C3

Isomeric SMILES

CC1=CC=CC=C1NC(=S)N2CCN(CC2)CC3=CSC=C3

InChI

InChI=1S/C17H21N3S2/c1-14-4-2-3-5-16(14)18-17(21)20-9-7-19(8-10-20)12-15-6-11-22-13-15/h2-6,11,13H,7-10,12H2,1H3,(H,18,21)