N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)carbamothioyl]-3-(4-propan-2-ylphenyl)prop-2-enamide

Systemtic Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)carbamothioyl]-3-(4-propan-2-ylphenyl)prop-2-enamide Openeye Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)carbamothioyl]-3-(4-isopropylphenyl)prop-2-enamide CAS Name: N-[[(3,5-dimethyl-1-phenyl-4-pyrazolyl)amino]-sulfanylidenemethyl]-3-(4-propan-2-ylphenyl)-2-propenamide IUPAC Name: N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)carbamothioyl]-3-(4-propan-2-ylphenyl)prop-2-enamide Traditional Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)thiocarbamoyl]-3-p-cumenyl-acrylamide Formula: C24H26N4OS MolecularWeight: 418.55444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)NC(=S)NC(=O)C=CC3=CC=C(C=C3)C(C)C

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)NC(=S)NC(=O)C=CC3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C24H26N4OS/c1-16(2)20-13-10-19(11-14-20)12-15-22(29)25-24(30)26-23-17(3)27-28(18(23)4)21-8-6-5-7-9-21/h5-16H,1-4H3,(H2,25,26,29,30)