ethyl 4-methyl-2-[[(Z)-(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)methyl]amino]-5-propan-2-yl-thiophene-3-carboxylate

Systemtic Name: ethyl 4-methyl-2-[[(Z)-(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)methyl]amino]-5-propan-2-yl-thiophene-3-carboxylate Openeye Name: ethyl 5-isopropyl-4-methyl-2-[[(Z)-(3-methyl-5-oxo-1-phenyl-pyrazol-4-ylidene)methyl]amino]thiophene-3-carboxylate CAS Name: 4-methyl-2-[[(Z)-(3-methyl-5-oxo-1-phenyl-4-pyrazolylidene)methyl]amino]-5-propan-2-yl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-[[(Z)-(3-methyl-5-oxo-1-phenylpyrazol-4-ylidene)methyl]amino]-5-propan-2-ylthiophene-3-carboxylate Traditional Name: 5-isopropyl-2-[[(Z)-(5-keto-3-methyl-1-phenyl-2-pyrazolin-4-ylidene)methyl]amino]-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C22H25N3O3S MolecularWeight: 411.5172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(C)C)NC=C2C(=NN(C2=O)C3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(C)C)N/C=C\2/C(=NN(C2=O)C3=CC=CC=C3)C

InChI

InChI=1S/C22H25N3O3S/c1-6-28-22(27)18-14(4)19(13(2)3)29-20(18)23-12-17-15(5)24-25(21(17)26)16-10-8-7-9-11-16/h7-13,23H,6H2,1-5H3/b17-12-