[2-[[4-(4-hexylphenyl)-1,3-thiazol-2-yl]amino]-2-oxidanylidene-1-phenyl-ethyl] 3,5-dimethoxybenzoate

Systemtic Name: [2-[[4-(4-hexylphenyl)-1,3-thiazol-2-yl]amino]-2-oxidanylidene-1-phenyl-ethyl] 3,5-dimethoxybenzoate Openeye Name: [2-[[4-(4-hexylphenyl)thiazol-2-yl]amino]-2-oxo-1-phenyl-ethyl] 3,5-dimethoxybenzoate CAS Name: 3,5-dimethoxybenzoic acid [2-[[4-(4-hexylphenyl)-2-thiazolyl]amino]-2-oxo-1-phenylethyl] ester IUPAC Name: [2-[[4-(4-hexylphenyl)-1,3-thiazol-2-yl]amino]-2-oxo-1-phenylethyl] 3,5-dimethoxybenzoate Traditional Name: 3,5-dimethoxybenzoic acid [2-[[4-(4-hexylphenyl)thiazol-2-yl]amino]-2-keto-1-phenyl-ethyl] ester Formula: C32H34N2O5S MolecularWeight: 558.68776

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C(C3=CC=CC=C3)OC(=O)C4=CC(=CC(=C4)OC)OC

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C(C3=CC=CC=C3)OC(=O)C4=CC(=CC(=C4)OC)OC

InChI

InChI=1S/C32H34N2O5S/c1-4-5-6-8-11-22-14-16-23(17-15-22)28-21-40-32(33-28)34-30(35)29(24-12-9-7-10-13-24)39-31(36)25-18-26(37-2)20-27(19-25)38-3/h7,9-10,12-21,29H,4-6,8,11H2,1-3H3,(H,33,34,35)