1-(2,4-dimethylphenyl)-5-[3-(2-methoxyphenyl)prop-2-enoylcarbamothioylamino]pyrazole-4-carboxamide

Systemtic Name: 1-(2,4-dimethylphenyl)-5-[3-(2-methoxyphenyl)prop-2-enoylcarbamothioylamino]pyrazole-4-carboxamide Openeye Name: 1-(2,4-dimethylphenyl)-5-[3-(2-methoxyphenyl)prop-2-enoylcarbamothioylamino]pyrazole-4-carboxamide CAS Name: 1-(2,4-dimethylphenyl)-5-[[[[3-(2-methoxyphenyl)-1-oxoprop-2-enyl]amino]-sulfanylidenemethyl]amino]-4-pyrazolecarboxamide IUPAC Name: 1-(2,4-dimethylphenyl)-5-[3-(2-methoxyphenyl)prop-2-enoylcarbamothioylamino]pyrazole-4-carboxamide Traditional Name: 1-(2,4-dimethylphenyl)-5-[[3-(2-methoxyphenyl)acryloyl]thiocarbamoylamino]pyrazole-4-carboxamide Formula: C23H23N5O3S MolecularWeight: 449.52542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C(=C(C=N2)C(=O)N)NC(=S)NC(=O)C=CC3=CC=CC=C3OC)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=C(C=N2)C(=O)N)NC(=S)NC(=O)C=CC3=CC=CC=C3OC)C

InChI

InChI=1S/C23H23N5O3S/c1-14-8-10-18(15(2)12-14)28-22(17(13-25-28)21(24)30)27-23(32)26-20(29)11-9-16-6-4-5-7-19(16)31-3/h4-13H,1-3H3,(H2,24,30)(H2,26,27,29,32)