N-(6-methyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-methylsulfonyl-benzamide

Systemtic Name: N-(6-methyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-methylsulfonyl-benzamide Openeye Name: N-(6-methyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-methylsulfonyl-benzamide CAS Name: N-(6-methyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-methylsulfonylbenzamide IUPAC Name: N-(6-methyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-methylsulfonylbenzamide Traditional Name: 2-mesyl-N-(6-methyl-3-propargyl-1,3-benzothiazol-2-ylidene)benzamide Formula: C19H16N2O3S2 MolecularWeight: 384.47194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=NC(=O)C3=CC=CC=C3S(=O)(=O)C)S2)CC#C

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=NC(=O)C3=CC=CC=C3S(=O)(=O)C)S2)CC#C

InChI

InChI=1S/C19H16N2O3S2/c1-4-11-21-15-10-9-13(2)12-16(15)25-19(21)20-18(22)14-7-5-6-8-17(14)26(3,23)24/h1,5-10,12H,11H2,2-3H3