2-diethylaminoethyl 5-[1-(3-methoxy-4-oxidanyl-phenyl)carbonyl-3,4-dihydro-2H-quinolin-6-yl]-6-methyl-2-oxidanylidene-6H-1,3,4-thiadiazine-3-carboxylate

Systemtic Name: 2-diethylaminoethyl 5-[1-(3-methoxy-4-oxidanyl-phenyl)carbonyl-3,4-dihydro-2H-quinolin-6-yl]-6-methyl-2-oxidanylidene-6H-1,3,4-thiadiazine-3-carboxylate Openeye Name: 2-diethylaminoethyl 5-[1-(4-hydroxy-3-methoxy-benzoyl)-3,4-dihydro-2H-quinolin-6-yl]-6-methyl-2-oxo-6H-1,3,4-thiadiazine-3-carboxylate CAS Name: 5-[1-[(4-hydroxy-3-methoxyphenyl)-oxomethyl]-3,4-dihydro-2H-quinolin-6-yl]-6-methyl-2-oxo-6H-1,3,4-thiadiazine-3-carboxylic acid 2-diethylaminoethyl ester IUPAC Name: 2-diethylaminoethyl 5-[1-(4-hydroxy-3-methoxybenzoyl)-3,4-dihydro-2H-quinolin-6-yl]-6-methyl-2-oxo-6H-1,3,4-thiadiazine-3-carboxylate Traditional Name: 2-keto-6-methyl-5-(1-vanilloyl-3,4-dihydro-2H-quinolin-6-yl)-6H-1,3,4-thiadiazine-3-carboxylic acid 2-diethylaminoethyl ester Formula: C28H34N4O6S MolecularWeight: 554.65776

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC(=O)N1C(=O)SC(C(=N1)C2=CC3=C(C=C2)N(CCC3)C(=O)C4=CC(=C(C=C4)O)OC)C

Isomeric SMILES

CCN(CC)CCOC(=O)N1C(=O)SC(C(=N1)C2=CC3=C(C=C2)N(CCC3)C(=O)C4=CC(=C(C=C4)O)OC)C

InChI

InChI=1S/C28H34N4O6S/c1-5-30(6-2)14-15-38-27(35)32-28(36)39-18(3)25(29-32)20-9-11-22-19(16-20)8-7-13-31(22)26(34)21-10-12-23(33)24(17-21)37-4/h9-12,16-18,33H,5-8,13-15H2,1-4H3