ethyl 2-[2-(4-methyl-2-oxidanylidene-quinolin-1-yl)propanoylamino]-1,3-benzothiazole-6-carboxylate

Systemtic Name: ethyl 2-[2-(4-methyl-2-oxidanylidene-quinolin-1-yl)propanoylamino]-1,3-benzothiazole-6-carboxylate Openeye Name: ethyl 2-[2-(4-methyl-2-oxo-1-quinolyl)propanoylamino]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[2-(4-methyl-2-oxo-1-quinolinyl)-1-oxopropyl]amino]-1,3-benzothiazole-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[2-(4-methyl-2-oxoquinolin-1-yl)propanoylamino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[2-(2-keto-4-methyl-1-quinolyl)propanoylamino]-1,3-benzothiazole-6-carboxylic acid ethyl ester Formula: C23H21N3O4S MolecularWeight: 435.49554

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C(C)N3C4=CC=CC=C4C(=CC3=O)C

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C(C)N3C4=CC=CC=C4C(=CC3=O)C

InChI

InChI=1S/C23H21N3O4S/c1-4-30-22(29)15-9-10-17-19(12-15)31-23(24-17)25-21(28)14(3)26-18-8-6-5-7-16(18)13(2)11-20(26)27/h5-12,14H,4H2,1-3H3,(H,24,25,28)