N-[(3-aminocarbonyl-4,5-dimethyl-thiophen-2-yl)carbamothioyl]-3-chloranyl-1-benzothiophene-2-carboxamide

Systemtic Name: N-[(3-aminocarbonyl-4,5-dimethyl-thiophen-2-yl)carbamothioyl]-3-chloranyl-1-benzothiophene-2-carboxamide Openeye Name: N-[(3-carbamoyl-4,5-dimethyl-2-thienyl)carbamothioyl]-3-chloro-benzothiophene-2-carboxamide CAS Name: N-[[(3-carbamoyl-4,5-dimethyl-2-thiophenyl)amino]-sulfanylidenemethyl]-3-chloro-1-benzothiophene-2-carboxamide IUPAC Name: N-[(3-carbamoyl-4,5-dimethylthiophen-2-yl)carbamothioyl]-3-chloro-1-benzothiophene-2-carboxamide Traditional Name: N-[(3-carbamoyl-4,5-dimethyl-2-thienyl)thiocarbamoyl]-3-chloro-benzothiophene-2-carboxamide Formula: C17H14ClN3O2S3 MolecularWeight: 423.95996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)N)NC(=S)NC(=O)C2=C(C3=CC=CC=C3S2)Cl)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)N)NC(=S)NC(=O)C2=C(C3=CC=CC=C3S2)Cl)C

InChI

InChI=1S/C17H14ClN3O2S3/c1-7-8(2)25-16(11(7)14(19)22)21-17(24)20-15(23)13-12(18)9-5-3-4-6-10(9)26-13/h3-6H,1-2H3,(H2,19,22)(H2,20,21,23,24)