2-ethylsulfanyl-8,8-dimethyl-5-phenyl-5,7,9,10-tetrahydro-1H-pyrimido[4,5-b]quinoline-4,6-dione

Systemtic Name: 2-ethylsulfanyl-8,8-dimethyl-5-phenyl-5,7,9,10-tetrahydro-1H-pyrimido[4,5-b]quinoline-4,6-dione Openeye Name: 2-ethylsulfanyl-8,8-dimethyl-5-phenyl-5,7,9,10-tetrahydro-1H-pyrimido[4,5-b]quinoline-4,6-dione CAS Name: 2-(ethylthio)-8,8-dimethyl-5-phenyl-5,7,9,10-tetrahydro-1H-pyrimido[4,5-b]quinoline-4,6-dione IUPAC Name: 2-ethylsulfanyl-8,8-dimethyl-5-phenyl-5,7,9,10-tetrahydro-1H-pyrimido[4,5-b]quinoline-4,6-dione Traditional Name: 2-(ethylthio)-8,8-dimethyl-5-phenyl-5,7,9,10-tetrahydro-1H-pyrimido[4,5-b]quinoline-4,6-quinone Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC(=O)C2=C(N1)NC3=C(C2C4=CC=CC=C4)C(=O)CC(C3)(C)C

Isomeric SMILES

CCSC1=NC(=O)C2=C(N1)NC3=C(C2C4=CC=CC=C4)C(=O)CC(C3)(C)C

InChI

InChI=1S/C21H23N3O2S/c1-4-27-20-23-18-17(19(26)24-20)15(12-8-6-5-7-9-12)16-13(22-18)10-21(2,3)11-14(16)25/h5-9,15H,4,10-11H2,1-3H3,(H2,22,23,24,26)