ethyl 4-[[5-methyl-2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]pyrazol-3-yl]amino]-4-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[[5-methyl-2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]pyrazol-3-yl]amino]-4-oxidanylidene-butanoate Openeye Name: ethyl 4-[[5-methyl-2-[4-(p-tolyl)thiazol-2-yl]pyrazol-3-yl]amino]-4-oxo-butanoate CAS Name: 4-[[5-methyl-2-[4-(4-methylphenyl)-2-thiazolyl]-3-pyrazolyl]amino]-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[[5-methyl-2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]pyrazol-3-yl]amino]-4-oxobutanoate Traditional Name: 4-keto-4-[[5-methyl-2-[4-(p-tolyl)thiazol-2-yl]pyrazol-3-yl]amino]butyric acid ethyl ester Formula: C20H22N4O3S MolecularWeight: 398.47868

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)NC1=CC(=NN1C2=NC(=CS2)C3=CC=C(C=C3)C)C

Isomeric SMILES

CCOC(=O)CCC(=O)NC1=CC(=NN1C2=NC(=CS2)C3=CC=C(C=C3)C)C

InChI

InChI=1S/C20H22N4O3S/c1-4-27-19(26)10-9-18(25)22-17-11-14(3)23-24(17)20-21-16(12-28-20)15-7-5-13(2)6-8-15/h5-8,11-12H,4,9-10H2,1-3H3,(H,22,25)