ethyl 4-[2-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)imino-4-thiophen-2-yl-1,3-thiazol-3-yl]butanoate

Systemtic Name: ethyl 4-[2-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)imino-4-thiophen-2-yl-1,3-thiazol-3-yl]butanoate Openeye Name: ethyl 4-[2-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)imino-4-(2-thienyl)thiazol-3-yl]butanoate CAS Name: 4-[2-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)imino]-4-thiophen-2-yl-3-thiazolyl]butanoic acid ethyl ester IUPAC Name: ethyl 4-[2-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)imino-4-thiophen-2-yl-1,3-thiazol-3-yl]butanoate Traditional Name: 4-[2-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)imino]-4-(2-thienyl)-4-thiazolin-3-yl]butyric acid ethyl ester Formula: C24H26N4O3S2 MolecularWeight: 482.61824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCN1C(=CSC1=NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C)C4=CC=CS4

Isomeric SMILES

CCOC(=O)CCCN1C(=CSC1=NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C)C4=CC=CS4

InChI

InChI=1S/C24H26N4O3S2/c1-4-31-21(29)13-8-14-27-19(20-12-9-15-32-20)16-33-24(27)25-22-17(2)26(3)28(23(22)30)18-10-6-5-7-11-18/h5-7,9-12,15-16H,4,8,13-14H2,1-3H3