ethyl 8-(imidazol-1-ylmethyl)-6-methoxy-7-oxidanylidene-2-(phenylsulfanylmethyl)-1H-quinoline-3-carboxylate

Systemtic Name: ethyl 8-(imidazol-1-ylmethyl)-6-methoxy-7-oxidanylidene-2-(phenylsulfanylmethyl)-1H-quinoline-3-carboxylate Openeye Name: ethyl 8-(imidazol-1-ylmethyl)-6-methoxy-7-oxo-2-(phenylsulfanylmethyl)-1H-quinoline-3-carboxylate CAS Name: 8-(1-imidazolylmethyl)-6-methoxy-7-oxo-2-[(phenylthio)methyl]-1H-quinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 8-(imidazol-1-ylmethyl)-6-methoxy-7-oxo-2-(phenylsulfanylmethyl)-1H-quinoline-3-carboxylate Traditional Name: 8-(imidazol-1-ylmethyl)-7-keto-6-methoxy-2-[(phenylthio)methyl]-1H-quinoline-3-carboxylic acid ethyl ester Formula: C24H23N3O4S MolecularWeight: 449.52212

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC2=C(C(=O)C(=CC2=C1)OC)CN3C=CN=C3)CSC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(NC2=C(C(=O)C(=CC2=C1)OC)CN3C=CN=C3)CSC4=CC=CC=C4

InChI

InChI=1S/C24H23N3O4S/c1-3-31-24(29)18-11-16-12-21(30-2)23(28)19(13-27-10-9-25-15-27)22(16)26-20(18)14-32-17-7-5-4-6-8-17/h4-12,15,26H,3,13-14H2,1-2H3