methyl 2-[1-(4-methoxyphenyl)-4-[C-methyl-N-(thiophen-2-ylmethyl)carbonimidoyl]-5-oxidanylidene-4H-pyrazol-3-yl]ethanoate

Systemtic Name: methyl 2-[1-(4-methoxyphenyl)-4-[C-methyl-N-(thiophen-2-ylmethyl)carbonimidoyl]-5-oxidanylidene-4H-pyrazol-3-yl]ethanoate Openeye Name: methyl 2-[1-(4-methoxyphenyl)-4-[C-methyl-N-(2-thienylmethyl)carbonimidoyl]-5-oxo-4H-pyrazol-3-yl]acetate CAS Name: 2-[1-(4-methoxyphenyl)-5-oxo-4-[1-(thiophen-2-ylmethylimino)ethyl]-4H-pyrazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[1-(4-methoxyphenyl)-4-[C-methyl-N-(thiophen-2-ylmethyl)carbonimidoyl]-5-oxo-4H-pyrazol-3-yl]acetate Traditional Name: 2-[5-keto-1-(4-methoxyphenyl)-4-[C-methyl-N-(2-thenyl)carbonimidoyl]-2-pyrazolin-3-yl]acetic acid methyl ester Formula: C20H21N3O4S MolecularWeight: 399.46344

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NCC1=CC=CS1)C2C(=NN(C2=O)C3=CC=C(C=C3)OC)CC(=O)OC

Isomeric SMILES

CC(=NCC1=CC=CS1)C2C(=NN(C2=O)C3=CC=C(C=C3)OC)CC(=O)OC

InChI

InChI=1S/C20H21N3O4S/c1-13(21-12-16-5-4-10-28-16)19-17(11-18(24)27-3)22-23(20(19)25)14-6-8-15(26-2)9-7-14/h4-10,19H,11-12H2,1-3H3