ethyl 2-[2-(6-chloranyl-2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoylamino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(6-chloranyl-2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(6-chloro-2-methyl-3-oxo-1,4-benzoxazin-4-yl)acetyl]amino]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2-(6-chloro-2-methyl-3-oxo-1,4-benzoxazin-4-yl)-1-oxoethyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(6-chloro-2-methyl-3-oxo-1,4-benzoxazin-4-yl)acetyl]amino]-4-phenylthiophene-3-carboxylate Traditional Name: 2-[[2-(6-chloro-3-keto-2-methyl-1,4-benzoxazin-4-yl)acetyl]amino]-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C24H21ClN2O5S MolecularWeight: 484.95194

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)CN3C4=C(C=CC(=C4)Cl)OC(C3=O)C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)CN3C4=C(C=CC(=C4)Cl)OC(C3=O)C

InChI

InChI=1S/C24H21ClN2O5S/c1-3-31-24(30)21-17(15-7-5-4-6-8-15)13-33-22(21)26-20(28)12-27-18-11-16(25)9-10-19(18)32-14(2)23(27)29/h4-11,13-14H,3,12H2,1-2H3,(H,26,28)