3-(1,3-benzothiazol-2-ylsulfanylmethyl)benzenecarbothioamide

Systemtic Name: 3-(1,3-benzothiazol-2-ylsulfanylmethyl)benzenecarbothioamide Openeye Name: 3-(1,3-benzothiazol-2-ylsulfanylmethyl)benzenecarbothioamide CAS Name: 3-[(1,3-benzothiazol-2-ylthio)methyl]benzenecarbothioamide IUPAC Name: 3-(1,3-benzothiazol-2-ylsulfanylmethyl)benzenecarbothioamide Traditional Name: 3-[(1,3-benzothiazol-2-ylthio)methyl]thiobenzamide Formula: C15H12N2S3 MolecularWeight: 316.46418

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)SCC3=CC=CC(=C3)C(=S)N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)SCC3=CC=CC(=C3)C(=S)N

InChI

InChI=1S/C15H12N2S3/c16-14(18)11-5-3-4-10(8-11)9-19-15-17-12-6-1-2-7-13(12)20-15/h1-8H,9H2,(H2,16,18)