methyl 2-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)imino-4-methyl-3-prop-2-enyl-1,3-thiazole-5-carboxylate

Systemtic Name: methyl 2-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)imino-4-methyl-3-prop-2-enyl-1,3-thiazole-5-carboxylate Openeye Name: methyl 3-allyl-2-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)imino-4-methyl-thiazole-5-carboxylate CAS Name: 2-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)imino]-4-methyl-3-prop-2-enyl-5-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)imino-4-methyl-3-prop-2-enyl-1,3-thiazole-5-carboxylate Traditional Name: 3-allyl-2-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)imino]-4-methyl-4-thiazoline-5-carboxylic acid methyl ester Formula: C20H22N4O3S MolecularWeight: 398.47868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N=C3N(C(=C(S3)C(=O)OC)C)CC=C

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N=C3N(C(=C(S3)C(=O)OC)C)CC=C

InChI

InChI=1S/C20H22N4O3S/c1-6-12-23-14(3)17(19(26)27-5)28-20(23)21-16-13(2)22(4)24(18(16)25)15-10-8-7-9-11-15/h6-11H,1,12H2,2-5H3