7-ethoxy-N-(6-methylsulfonyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-1-benzofuran-2-carboxamide

Systemtic Name: 7-ethoxy-N-(6-methylsulfonyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-1-benzofuran-2-carboxamide Openeye Name: 7-ethoxy-N-(6-methylsulfonyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)benzofuran-2-carboxamide CAS Name: 7-ethoxy-N-(6-methylsulfonyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-benzofurancarboxamide IUPAC Name: 7-ethoxy-N-(6-methylsulfonyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-1-benzofuran-2-carboxamide Traditional Name: 7-ethoxy-N-(6-mesyl-3-propargyl-1,3-benzothiazol-2-ylidene)coumarilamide Formula: C22H18N2O5S2 MolecularWeight: 454.51872

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC2=C1OC(=C2)C(=O)N=C3N(C4=C(S3)C=C(C=C4)S(=O)(=O)C)CC#C

Isomeric SMILES

CCOC1=CC=CC2=C1OC(=C2)C(=O)N=C3N(C4=C(S3)C=C(C=C4)S(=O)(=O)C)CC#C

InChI

InChI=1S/C22H18N2O5S2/c1-4-11-24-16-10-9-15(31(3,26)27)13-19(16)30-22(24)23-21(25)18-12-14-7-6-8-17(28-5-2)20(14)29-18/h1,6-10,12-13H,5,11H2,2-3H3