2,5-bis(chloranyl)-N-(5,6-dimethoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)thiophene-3-carboxamide

Systemtic Name: 2,5-bis(chloranyl)-N-(5,6-dimethoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)thiophene-3-carboxamide Openeye Name: 2,5-dichloro-N-(5,6-dimethoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)thiophene-3-carboxamide CAS Name: 2,5-dichloro-N-(5,6-dimethoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3-thiophenecarboxamide IUPAC Name: 2,5-dichloro-N-(5,6-dimethoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)thiophene-3-carboxamide Traditional Name: 2,5-dichloro-N-(5,6-dimethoxy-3-propargyl-1,3-benzothiazol-2-ylidene)thiophene-3-carboxamide Formula: C17H12Cl2N2O3S2 MolecularWeight: 427.32478

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H12Cl2N2O3S2/c1-4-5-21-10-7-11(23-2)12(24-3)8-13(10)25-17(21)20-16(22)9-6-14(18)26-15(9)19/h1,6-8H,5H2,2-3H3