(NZ)-5-chloranyl-N-(4,7-dimethoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)thiophene-2-sulfonamide

Systemtic Name: (NZ)-5-chloranyl-N-(4,7-dimethoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)thiophene-2-sulfonamide Openeye Name: (NZ)-5-chloro-N-(4,7-dimethoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)thiophene-2-sulfonamide CAS Name: (NZ)-5-chloro-N-(4,7-dimethoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-thiophenesulfonamide IUPAC Name: (NZ)-5-chloro-N-(4,7-dimethoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)thiophene-2-sulfonamide Traditional Name: (NZ)-5-chloro-N-(4,7-dimethoxy-3-propargyl-1,3-benzothiazol-2-ylidene)thiophene-2-sulfonamide Formula: C16H13ClN2O4S3 MolecularWeight: 428.93342

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)OC)SC(=NS(=O)(=O)C3=CC=C(S3)Cl)N2CC#C

Isomeric SMILES

COC1=C2C(=C(C=C1)OC)S/C(=N\S(=O)(=O)C3=CC=C(S3)Cl)/N2CC#C

InChI

InChI=1S/C16H13ClN2O4S3/c1-4-9-19-14-10(22-2)5-6-11(23-3)15(14)25-16(19)18-26(20,21)13-8-7-12(17)24-13/h1,5-8H,9H2,2-3H3/b18-16-