(E)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-(1-phenylpyrazol-4-yl)prop-2-enamide

Systemtic Name: (E)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-(1-phenylpyrazol-4-yl)prop-2-enamide Openeye Name: (E)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-(1-phenylpyrazol-4-yl)prop-2-enamide CAS Name: (E)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-(1-phenyl-4-pyrazolyl)-2-propenamide IUPAC Name: (E)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-(1-phenylpyrazol-4-yl)prop-2-enamide Traditional Name: (E)-N-(6-mesyl-1,3-benzothiazol-2-yl)-3-(1-phenylpyrazol-4-yl)acrylamide Formula: C20H16N4O3S2 MolecularWeight: 424.49604

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C=CC3=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)/C=C/C3=CN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C20H16N4O3S2/c1-29(26,27)16-8-9-17-18(11-16)28-20(22-17)23-19(25)10-7-14-12-21-24(13-14)15-5-3-2-4-6-15/h2-13H,1H3,(H,22,23,25)/b10-7+