2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-5-phenyl-1H-pyrimidine-4,6-dione

Systemtic Name: 2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-5-phenyl-1H-pyrimidine-4,6-dione Openeye Name: 2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxo-ethyl]sulfanyl-5-phenyl-1H-pyrimidine-4,6-dione CAS Name: 2-[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]thio]-5-phenyl-1H-pyrimidine-4,6-dione IUPAC Name: 2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]sulfanyl-5-phenyl-1H-pyrimidine-4,6-dione Traditional Name: 2-[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-keto-ethyl]thio]-5-phenyl-1H-pyrimidine-4,6-quinone Formula: C21H19N3O3S MolecularWeight: 393.45886

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2N(C1)C(=O)CSC3=NC(=O)C(C(=O)N3)C4=CC=CC=C4

Isomeric SMILES

C1CC2=CC=CC=C2N(C1)C(=O)CSC3=NC(=O)C(C(=O)N3)C4=CC=CC=C4

InChI

InChI=1S/C21H19N3O3S/c25-17(24-12-6-10-14-7-4-5-11-16(14)24)13-28-21-22-19(26)18(20(27)23-21)15-8-2-1-3-9-15/h1-5,7-9,11,18H,6,10,12-13H2,(H,22,23,26,27)