[2-(4-ethylphenyl)-1,3-thiazol-4-yl]methyl (E)-3-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)prop-2-enoate

Systemtic Name: [2-(4-ethylphenyl)-1,3-thiazol-4-yl]methyl (E)-3-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)prop-2-enoate Openeye Name: [2-(4-ethylphenyl)thiazol-4-yl]methyl (E)-3-(5-chloro-1,3-dimethyl-pyrazol-4-yl)prop-2-enoate CAS Name: (E)-3-(5-chloro-1,3-dimethyl-4-pyrazolyl)-2-propenoic acid [2-(4-ethylphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-ethylphenyl)-1,3-thiazol-4-yl]methyl (E)-3-(5-chloro-1,3-dimethylpyrazol-4-yl)prop-2-enoate Traditional Name: (E)-3-(5-chloro-1,3-dimethyl-pyrazol-4-yl)acrylic acid [2-(4-ethylphenyl)thiazol-4-yl]methyl ester Formula: C20H20ClN3O2S MolecularWeight: 401.9097

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC(=CS2)COC(=O)C=CC3=C(N(N=C3C)C)Cl

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC(=CS2)COC(=O)/C=C/C3=C(N(N=C3C)C)Cl

InChI

InChI=1S/C20H20ClN3O2S/c1-4-14-5-7-15(8-6-14)20-22-16(12-27-20)11-26-18(25)10-9-17-13(2)23-24(3)19(17)21/h5-10,12H,4,11H2,1-3H3/b10-9+