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

Systemtic Name: 5-(3,4-dimethylphenyl)-N-[(6-ethoxy-1,3-benzothiazol-2-yl)carbamothioyl]furan-2-carboxamide Openeye Name: 5-(3,4-dimethylphenyl)-N-[(6-ethoxy-1,3-benzothiazol-2-yl)carbamothioyl]furan-2-carboxamide CAS Name: 5-(3,4-dimethylphenyl)-N-[[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-(3,4-dimethylphenyl)-N-[(6-ethoxy-1,3-benzothiazol-2-yl)carbamothioyl]furan-2-carboxamide Traditional Name: 5-(3,4-dimethylphenyl)-N-[(6-ethoxy-1,3-benzothiazol-2-yl)thiocarbamoyl]-2-furamide Formula: C23H21N3O3S2 MolecularWeight: 451.56114

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=S)NC(=O)C3=CC=C(O3)C4=CC(=C(C=C4)C)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=S)NC(=O)C3=CC=C(O3)C4=CC(=C(C=C4)C)C

InChI

InChI=1S/C23H21N3O3S2/c1-4-28-16-7-8-17-20(12-16)31-23(24-17)26-22(30)25-21(27)19-10-9-18(29-19)15-6-5-13(2)14(3)11-15/h5-12H,4H2,1-3H3,(H2,24,25,26,27,30)