3-chloranyl-N-[(5-ethanoyl-4-methyl-1,3-thiazol-2-yl)carbamothioyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[(5-ethanoyl-4-methyl-1,3-thiazol-2-yl)carbamothioyl]-1-benzothiophene-2-carboxamide Openeye Name: N-[(5-acetyl-4-methyl-thiazol-2-yl)carbamothioyl]-3-chloro-benzothiophene-2-carboxamide CAS Name: N-[[(5-acetyl-4-methyl-2-thiazolyl)amino]-sulfanylidenemethyl]-3-chloro-1-benzothiophene-2-carboxamide IUPAC Name: N-[(5-acetyl-4-methyl-1,3-thiazol-2-yl)carbamothioyl]-3-chloro-1-benzothiophene-2-carboxamide Traditional Name: N-[(5-acetyl-4-methyl-thiazol-2-yl)thiocarbamoyl]-3-chloro-benzothiophene-2-carboxamide Formula: C16H12ClN3O2S3 MolecularWeight: 409.93338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=S)NC(=O)C2=C(C3=CC=CC=C3S2)Cl)C(=O)C

Isomeric SMILES

CC1=C(SC(=N1)NC(=S)NC(=O)C2=C(C3=CC=CC=C3S2)Cl)C(=O)C

InChI

InChI=1S/C16H12ClN3O2S3/c1-7-12(8(2)21)25-16(18-7)20-15(23)19-14(22)13-11(17)9-5-3-4-6-10(9)24-13/h3-6H,1-2H3,(H2,18,19,20,22,23)