(E)-N-(6-methylsulfonyl-3-propyl-1,3-benzothiazol-2-ylidene)-3-phenyl-prop-2-enamide

Systemtic Name: (E)-N-(6-methylsulfonyl-3-propyl-1,3-benzothiazol-2-ylidene)-3-phenyl-prop-2-enamide Openeye Name: (E)-N-(6-methylsulfonyl-3-propyl-1,3-benzothiazol-2-ylidene)-3-phenyl-prop-2-enamide CAS Name: (E)-N-(6-methylsulfonyl-3-propyl-1,3-benzothiazol-2-ylidene)-3-phenyl-2-propenamide IUPAC Name: (E)-N-(6-methylsulfonyl-3-propyl-1,3-benzothiazol-2-ylidene)-3-phenylprop-2-enamide Traditional Name: (E)-N-(6-mesyl-3-propyl-1,3-benzothiazol-2-ylidene)-3-phenyl-acrylamide Formula: C20H20N2O3S2 MolecularWeight: 400.5144

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)C)SC1=NC(=O)C=CC3=CC=CC=C3

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)C)SC1=NC(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C20H20N2O3S2/c1-3-13-22-17-11-10-16(27(2,24)25)14-18(17)26-20(22)21-19(23)12-9-15-7-5-4-6-8-15/h4-12,14H,3,13H2,1-2H3/b12-9+,21-20?