3-chloranyl-N-[(3,6-dimethyl-1,3-benzothiazol-2-ylidene)carbamothioyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[(3,6-dimethyl-1,3-benzothiazol-2-ylidene)carbamothioyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[(3,6-dimethyl-1,3-benzothiazol-2-ylidene)carbamothioyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[[(3,6-dimethyl-1,3-benzothiazol-2-ylidene)amino]-sulfanylidenemethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[(3,6-dimethyl-1,3-benzothiazol-2-ylidene)carbamothioyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[(3,6-dimethyl-1,3-benzothiazol-2-ylidene)thiocarbamoyl]benzothiophene-2-carboxamide Formula: C19H14ClN3OS3 MolecularWeight: 431.98196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=NC(=S)NC(=O)C3=C(C4=CC=CC=C4S3)Cl)S2)C

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=NC(=S)NC(=O)C3=C(C4=CC=CC=C4S3)Cl)S2)C

InChI

InChI=1S/C19H14ClN3OS3/c1-10-7-8-12-14(9-10)27-19(23(12)2)22-18(25)21-17(24)16-15(20)11-5-3-4-6-13(11)26-16/h3-9H,1-2H3,(H,21,24,25)