methyl 2-chloranyl-5-[[4-(3-ethyl-4-methyl-2-oxidanylidene-1,3-thiazol-5-yl)pyrimidin-2-yl]amino]benzoate

Systemtic Name: methyl 2-chloranyl-5-[[4-(3-ethyl-4-methyl-2-oxidanylidene-1,3-thiazol-5-yl)pyrimidin-2-yl]amino]benzoate Openeye Name: methyl 2-chloro-5-[[4-(3-ethyl-4-methyl-2-oxo-thiazol-5-yl)pyrimidin-2-yl]amino]benzoate CAS Name: 2-chloro-5-[[4-(3-ethyl-4-methyl-2-oxo-5-thiazolyl)-2-pyrimidinyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-chloro-5-[[4-(3-ethyl-4-methyl-2-oxo-1,3-thiazol-5-yl)pyrimidin-2-yl]amino]benzoate Traditional Name: 2-chloro-5-[[4-(3-ethyl-2-keto-4-methyl-4-thiazolin-5-yl)pyrimidin-2-yl]amino]benzoic acid methyl ester Formula: C18H17ClN4O3S MolecularWeight: 404.87058

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(SC1=O)C2=NC(=NC=C2)NC3=CC(=C(C=C3)Cl)C(=O)OC)C

Isomeric SMILES

CCN1C(=C(SC1=O)C2=NC(=NC=C2)NC3=CC(=C(C=C3)Cl)C(=O)OC)C

InChI

InChI=1S/C18H17ClN4O3S/c1-4-23-10(2)15(27-18(23)25)14-7-8-20-17(22-14)21-11-5-6-13(19)12(9-11)16(24)26-3/h5-9H,4H2,1-3H3,(H,20,21,22)