(NZ)-4-chloranyl-N-(5,6-dimethoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)benzenesulfonamide

Systemtic Name: (NZ)-4-chloranyl-N-(5,6-dimethoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)benzenesulfonamide Openeye Name: (NZ)-4-chloro-N-(5,6-dimethoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)benzenesulfonamide CAS Name: (NZ)-4-chloro-N-(5,6-dimethoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)benzenesulfonamide IUPAC Name: (NZ)-4-chloro-N-(5,6-dimethoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)benzenesulfonamide Traditional Name: (NZ)-4-chloro-N-(5,6-dimethoxy-3-propargyl-1,3-benzothiazol-2-ylidene)benzenesulfonamide Formula: C18H15ClN2O4S2 MolecularWeight: 422.9057

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)N(C(=NS(=O)(=O)C3=CC=C(C=C3)Cl)S2)CC#C)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)N(/C(=N/S(=O)(=O)C3=CC=C(C=C3)Cl)/S2)CC#C)OC

InChI

InChI=1S/C18H15ClN2O4S2/c1-4-9-21-14-10-15(24-2)16(25-3)11-17(14)26-18(21)20-27(22,23)13-7-5-12(19)6-8-13/h1,5-8,10-11H,9H2,2-3H3/b20-18-