N-(3,5-dimethylphenyl)-4-(thiophen-3-ylmethyl)piperazine-1-carbothioamide

Systemtic Name: N-(3,5-dimethylphenyl)-4-(thiophen-3-ylmethyl)piperazine-1-carbothioamide Openeye Name: N-(3,5-dimethylphenyl)-4-(3-thienylmethyl)piperazine-1-carbothioamide CAS Name: N-(3,5-dimethylphenyl)-4-(3-thiophenylmethyl)-1-piperazinecarbothioamide IUPAC Name: N-(3,5-dimethylphenyl)-4-(thiophen-3-ylmethyl)piperazine-1-carbothioamide Traditional Name: N-(3,5-dimethylphenyl)-4-(3-thenyl)piperazine-1-carbothioamide Formula: C18H23N3S2 MolecularWeight: 345.52532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=S)N2CCN(CC2)CC3=CSC=C3)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=S)N2CCN(CC2)CC3=CSC=C3)C

InChI

InChI=1S/C18H23N3S2/c1-14-9-15(2)11-17(10-14)19-18(22)21-6-4-20(5-7-21)12-16-3-8-23-13-16/h3,8-11,13H,4-7,12H2,1-2H3,(H,19,22)