N-(6-methoxy-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-4-methylsulfonyl-benzamide

Systemtic Name: N-(6-methoxy-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-4-methylsulfonyl-benzamide Openeye Name: N-(3-allyl-6-methoxy-1,3-benzothiazol-2-ylidene)-4-methylsulfonyl-benzamide CAS Name: N-(6-methoxy-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-4-methylsulfonylbenzamide IUPAC Name: N-(6-methoxy-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-4-methylsulfonylbenzamide Traditional Name: N-(3-allyl-6-methoxy-1,3-benzothiazol-2-ylidene)-4-mesyl-benzamide Formula: C19H18N2O4S2 MolecularWeight: 402.48722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N(C(=NC(=O)C3=CC=C(C=C3)S(=O)(=O)C)S2)CC=C

Isomeric SMILES

COC1=CC2=C(C=C1)N(C(=NC(=O)C3=CC=C(C=C3)S(=O)(=O)C)S2)CC=C

InChI

InChI=1S/C19H18N2O4S2/c1-4-11-21-16-10-7-14(25-2)12-17(16)26-19(21)20-18(22)13-5-8-15(9-6-13)27(3,23)24/h4-10,12H,1,11H2,2-3H3