ethyl 2-[3-(6-chloranyl-2-oxidanylidene-1,3-benzoxazol-3-yl)propanoylamino]-4-phenyl-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 2-[3-(6-chloranyl-2-oxidanylidene-1,3-benzoxazol-3-yl)propanoylamino]-4-phenyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[3-(6-chloro-2-oxo-1,3-benzoxazol-3-yl)propanoylamino]-4-phenyl-thiazole-5-carboxylate CAS Name: 2-[[3-(6-chloro-2-oxo-1,3-benzoxazol-3-yl)-1-oxopropyl]amino]-4-phenyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[3-(6-chloro-2-oxo-1,3-benzoxazol-3-yl)propanoylamino]-4-phenyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[3-(6-chloro-2-keto-1,3-benzoxazol-3-yl)propanoylamino]-4-phenyl-thiazole-5-carboxylic acid ethyl ester Formula: C22H18ClN3O5S MolecularWeight: 471.91342

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC(=O)CCN2C3=C(C=C(C=C3)Cl)OC2=O)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC(=O)CCN2C3=C(C=C(C=C3)Cl)OC2=O)C4=CC=CC=C4

InChI

InChI=1S/C22H18ClN3O5S/c1-2-30-20(28)19-18(13-6-4-3-5-7-13)25-21(32-19)24-17(27)10-11-26-15-9-8-14(23)12-16(15)31-22(26)29/h3-9,12H,2,10-11H2,1H3,(H,24,25,27)