[1-(3,4-dihydro-2H-quinolin-1-yl)-1-oxidanylidene-butan-2-yl] 2-(1,3-benzothiazol-2-yl)benzoate

Systemtic Name: [1-(3,4-dihydro-2H-quinolin-1-yl)-1-oxidanylidene-butan-2-yl] 2-(1,3-benzothiazol-2-yl)benzoate Openeye Name: 1-(3,4-dihydro-2H-quinoline-1-carbonyl)propyl 2-(1,3-benzothiazol-2-yl)benzoate CAS Name: 2-(1,3-benzothiazol-2-yl)benzoic acid [1-(3,4-dihydro-2H-quinolin-1-yl)-1-oxobutan-2-yl] ester IUPAC Name: [1-(3,4-dihydro-2H-quinolin-1-yl)-1-oxobutan-2-yl] 2-(1,3-benzothiazol-2-yl)benzoate Traditional Name: 2-(1,3-benzothiazol-2-yl)benzoic acid 1-(3,4-dihydro-2H-quinoline-1-carbonyl)propyl ester Formula: C27H24N2O3S MolecularWeight: 456.55606

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1CCCC2=CC=CC=C21)OC(=O)C3=CC=CC=C3C4=NC5=CC=CC=C5S4

Isomeric SMILES

CCC(C(=O)N1CCCC2=CC=CC=C21)OC(=O)C3=CC=CC=C3C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C27H24N2O3S/c1-2-23(26(30)29-17-9-11-18-10-3-7-15-22(18)29)32-27(31)20-13-5-4-12-19(20)25-28-21-14-6-8-16-24(21)33-25/h3-8,10,12-16,23H,2,9,11,17H2,1H3