(2-chloranyl-7-methoxy-quinolin-3-yl)methyl 2-(prop-2-enylamino)-1,3-thiazole-4-carboxylate

Systemtic Name: (2-chloranyl-7-methoxy-quinolin-3-yl)methyl 2-(prop-2-enylamino)-1,3-thiazole-4-carboxylate Openeye Name: (2-chloro-7-methoxy-3-quinolyl)methyl 2-(allylamino)thiazole-4-carboxylate CAS Name: 2-(prop-2-enylamino)-4-thiazolecarboxylic acid (2-chloro-7-methoxy-3-quinolinyl)methyl ester IUPAC Name: (2-chloro-7-methoxyquinolin-3-yl)methyl 2-(prop-2-enylamino)-1,3-thiazole-4-carboxylate Traditional Name: 2-(allylamino)thiazole-4-carboxylic acid (2-chloro-7-methoxy-3-quinolyl)methyl ester Formula: C18H16ClN3O3S MolecularWeight: 389.85594

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=NC(=C(C=C2C=C1)COC(=O)C3=CSC(=N3)NCC=C)Cl

Isomeric SMILES

COC1=CC2=NC(=C(C=C2C=C1)COC(=O)C3=CSC(=N3)NCC=C)Cl

InChI

InChI=1S/C18H16ClN3O3S/c1-3-6-20-18-22-15(10-26-18)17(23)25-9-12-7-11-4-5-13(24-2)8-14(11)21-16(12)19/h3-5,7-8,10H,1,6,9H2,2H3,(H,20,22)