N-[(4,6-dimethoxy-1,3-benzothiazol-2-yl)carbamothioyl]-2-phenoxy-ethanamide

Systemtic Name: N-[(4,6-dimethoxy-1,3-benzothiazol-2-yl)carbamothioyl]-2-phenoxy-ethanamide Openeye Name: N-[(4,6-dimethoxy-1,3-benzothiazol-2-yl)carbamothioyl]-2-phenoxy-acetamide CAS Name: N-[[(4,6-dimethoxy-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]-2-phenoxyacetamide IUPAC Name: N-[(4,6-dimethoxy-1,3-benzothiazol-2-yl)carbamothioyl]-2-phenoxyacetamide Traditional Name: N-[(4,6-dimethoxy-1,3-benzothiazol-2-yl)thiocarbamoyl]-2-phenoxy-acetamide Formula: C18H17N3O4S2 MolecularWeight: 403.47528

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C2C(=C1)SC(=N2)NC(=S)NC(=O)COC3=CC=CC=C3)OC

Isomeric SMILES

COC1=CC(=C2C(=C1)SC(=N2)NC(=S)NC(=O)COC3=CC=CC=C3)OC

InChI

InChI=1S/C18H17N3O4S2/c1-23-12-8-13(24-2)16-14(9-12)27-18(20-16)21-17(26)19-15(22)10-25-11-6-4-3-5-7-11/h3-9H,10H2,1-2H3,(H2,19,20,21,22,26)