4-(thiomorpholin-4-ylsulfonylmethyl)benzenecarbothioamide

Systemtic Name: 4-(thiomorpholin-4-ylsulfonylmethyl)benzenecarbothioamide Openeye Name: 4-(thiomorpholinosulfonylmethyl)benzenecarbothioamide CAS Name: 4-(thiomorpholin-4-ylsulfonylmethyl)benzenecarbothioamide IUPAC Name: 4-(thiomorpholin-4-ylsulfonylmethyl)benzenecarbothioamide Traditional Name: 4-(thiomorpholinosulfonylmethyl)thiobenzamide Formula: C12H16N2O2S3 MolecularWeight: 316.46264

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCCN1S(=O)(=O)CC2=CC=C(C=C2)C(=S)N

Isomeric SMILES

C1CSCCN1S(=O)(=O)CC2=CC=C(C=C2)C(=S)N

InChI

InChI=1S/C12H16N2O2S3/c13-12(17)11-3-1-10(2-4-11)9-19(15,16)14-5-7-18-8-6-14/h1-4H,5-9H2,(H2,13,17)