ethyl 2-[[2-[(3-aminocarbonyl-4-azanyl-1,2-thiazol-5-yl)carbonyl-phenyl-amino]-2-quinolin-6-yl-ethanoyl]amino]ethanoate

Systemtic Name: ethyl 2-[[2-[(3-aminocarbonyl-4-azanyl-1,2-thiazol-5-yl)carbonyl-phenyl-amino]-2-quinolin-6-yl-ethanoyl]amino]ethanoate Openeye Name: ethyl 2-[[2-(N-(4-amino-3-carbamoyl-isothiazole-5-carbonyl)anilino)-2-(6-quinolyl)acetyl]amino]acetate CAS Name: 2-[[2-(N-[(4-amino-3-carbamoyl-5-isothiazolyl)-oxomethyl]anilino)-1-oxo-2-(6-quinolinyl)ethyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[2-(N-(4-amino-3-carbamoyl-1,2-thiazole-5-carbonyl)anilino)-2-quinolin-6-ylacetyl]amino]acetate Traditional Name: 2-[[2-(N-(4-amino-3-carbamoyl-isothiazole-5-carbonyl)anilino)-2-(6-quinolyl)acetyl]amino]acetic acid ethyl ester Formula: C26H24N6O5S MolecularWeight: 532.57096

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=O)C(C1=CC2=C(C=C1)N=CC=C2)N(C3=CC=CC=C3)C(=O)C4=C(C(=NS4)C(=O)N)N

Isomeric SMILES

CCOC(=O)CNC(=O)C(C1=CC2=C(C=C1)N=CC=C2)N(C3=CC=CC=C3)C(=O)C4=C(C(=NS4)C(=O)N)N

InChI

InChI=1S/C26H24N6O5S/c1-2-37-19(33)14-30-25(35)22(16-10-11-18-15(13-16)7-6-12-29-18)32(17-8-4-3-5-9-17)26(36)23-20(27)21(24(28)34)31-38-23/h3-13,22H,2,14,27H2,1H3,(H2,28,34)(H,30,35)