N-[[4-[(6-methoxypyridazin-3-yl)sulfamoyl]phenyl]carbamothioyl]-3-(4-methylphenyl)prop-2-enamide

Systemtic Name: N-[[4-[(6-methoxypyridazin-3-yl)sulfamoyl]phenyl]carbamothioyl]-3-(4-methylphenyl)prop-2-enamide Openeye Name: N-[[4-[(6-methoxypyridazin-3-yl)sulfamoyl]phenyl]carbamothioyl]-3-(p-tolyl)prop-2-enamide CAS Name: N-[[4-[(6-methoxy-3-pyridazinyl)sulfamoyl]anilino]-sulfanylidenemethyl]-3-(4-methylphenyl)-2-propenamide IUPAC Name: N-[[4-[(6-methoxypyridazin-3-yl)sulfamoyl]phenyl]carbamothioyl]-3-(4-methylphenyl)prop-2-enamide Traditional Name: N-[[4-[(6-methoxypyridazin-3-yl)sulfamoyl]phenyl]thiocarbamoyl]-3-(p-tolyl)acrylamide Formula: C22H21N5O4S2 MolecularWeight: 483.56324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=CC(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=NN=C(C=C3)OC

Isomeric SMILES

CC1=CC=C(C=C1)C=CC(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=NN=C(C=C3)OC

InChI

InChI=1S/C22H21N5O4S2/c1-15-3-5-16(6-4-15)7-13-20(28)24-22(32)23-17-8-10-18(11-9-17)33(29,30)27-19-12-14-21(31-2)26-25-19/h3-14H,1-2H3,(H,25,27)(H2,23,24,28,32)