ethyl 4-[[4-methyl-3-[(4-pyridin-3-yl-1,3-thiazol-2-yl)amino]phenyl]carbamoylamino]benzoate

Systemtic Name: ethyl 4-[[4-methyl-3-[(4-pyridin-3-yl-1,3-thiazol-2-yl)amino]phenyl]carbamoylamino]benzoate Openeye Name: ethyl 4-[[4-methyl-3-[[4-(3-pyridyl)thiazol-2-yl]amino]phenyl]carbamoylamino]benzoate CAS Name: 4-[[[4-methyl-3-[[4-(3-pyridinyl)-2-thiazolyl]amino]anilino]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[4-methyl-3-[(4-pyridin-3-yl-1,3-thiazol-2-yl)amino]phenyl]carbamoylamino]benzoate Traditional Name: 4-[[4-methyl-3-[[4-(3-pyridyl)thiazol-2-yl]amino]phenyl]carbamoylamino]benzoic acid ethyl ester Formula: C25H23N5O3S MolecularWeight: 473.54682

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)NC2=CC(=C(C=C2)C)NC3=NC(=CS3)C4=CN=CC=C4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)NC2=CC(=C(C=C2)C)NC3=NC(=CS3)C4=CN=CC=C4

InChI

InChI=1S/C25H23N5O3S/c1-3-33-23(31)17-7-10-19(11-8-17)27-24(32)28-20-9-6-16(2)21(13-20)29-25-30-22(15-34-25)18-5-4-12-26-14-18/h4-15H,3H2,1-2H3,(H,29,30)(H2,27,28,32)