5-(3,4-dichlorophenyl)-N-[(4,6-dimethoxy-1,3-benzothiazol-2-yl)carbamothioyl]furan-2-carboxamide

Systemtic Name: 5-(3,4-dichlorophenyl)-N-[(4,6-dimethoxy-1,3-benzothiazol-2-yl)carbamothioyl]furan-2-carboxamide Openeye Name: 5-(3,4-dichlorophenyl)-N-[(4,6-dimethoxy-1,3-benzothiazol-2-yl)carbamothioyl]furan-2-carboxamide CAS Name: 5-(3,4-dichlorophenyl)-N-[[(4,6-dimethoxy-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-(3,4-dichlorophenyl)-N-[(4,6-dimethoxy-1,3-benzothiazol-2-yl)carbamothioyl]furan-2-carboxamide Traditional Name: 5-(3,4-dichlorophenyl)-N-[(4,6-dimethoxy-1,3-benzothiazol-2-yl)thiocarbamoyl]-2-furamide Formula: C21H15Cl2N3O4S2 MolecularWeight: 508.3975

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C2C(=C1)SC(=N2)NC(=S)NC(=O)C3=CC=C(O3)C4=CC(=C(C=C4)Cl)Cl)OC

Isomeric SMILES

COC1=CC(=C2C(=C1)SC(=N2)NC(=S)NC(=O)C3=CC=C(O3)C4=CC(=C(C=C4)Cl)Cl)OC

InChI

InChI=1S/C21H15Cl2N3O4S2/c1-28-11-8-16(29-2)18-17(9-11)32-21(24-18)26-20(31)25-19(27)15-6-5-14(30-15)10-3-4-12(22)13(23)7-10/h3-9H,1-2H3,(H2,24,25,26,27,31)