N-(phenylmethyl)-4-thiophen-2-ylsulfonyl-piperazine-1-carbothioamide

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=S)NCC2=CC=CC=C2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

C1CN(CCN1C(=S)NCC2=CC=CC=C2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C16H19N3O2S3/c20-24(21,15-7-4-12-23-15)19-10-8-18(9-11-19)16(22)17-13-14-5-2-1-3-6-14/h1-7,12H,8-11,13H2,(H,17,22)