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

Systemtic Name: N-(3-methylphenyl)-4-thiophen-2-ylsulfonyl-piperazine-1-carbothioamide Openeye Name: N-(m-tolyl)-4-(2-thienylsulfonyl)piperazine-1-carbothioamide CAS Name: N-(3-methylphenyl)-4-thiophen-2-ylsulfonyl-1-piperazinecarbothioamide IUPAC Name: N-(3-methylphenyl)-4-thiophen-2-ylsulfonylpiperazine-1-carbothioamide Traditional Name: N-(m-tolyl)-4-(2-thienylsulfonyl)piperazine-1-carbothioamide Formula: C16H19N3O2S3 MolecularWeight: 381.53596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=S)N2CCN(CC2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CC1=CC(=CC=C1)NC(=S)N2CCN(CC2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C16H19N3O2S3/c1-13-4-2-5-14(12-13)17-16(22)18-7-9-19(10-8-18)24(20,21)15-6-3-11-23-15/h2-6,11-12H,7-10H2,1H3,(H,17,22)