6,7-diethoxy-3-[(4-pyrrolidin-1-ylcarbonylphenyl)methyl]-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 6,7-diethoxy-3-[(4-pyrrolidin-1-ylcarbonylphenyl)methyl]-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 6,7-diethoxy-3-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]-2-thioxo-1H-quinazolin-4-one CAS Name: 6,7-diethoxy-3-[[4-[oxo(1-pyrrolidinyl)methyl]phenyl]methyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 6,7-diethoxy-3-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 6,7-diethoxy-3-[4-(pyrrolidine-1-carbonyl)benzyl]-2-thioxo-1H-quinazolin-4-one Formula: C24H27N3O4S MolecularWeight: 453.55388

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)C(=O)N(C(=S)N2)CC3=CC=C(C=C3)C(=O)N4CCCC4)OCC

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C(=O)N(C(=S)N2)CC3=CC=C(C=C3)C(=O)N4CCCC4)OCC

InChI

InChI=1S/C24H27N3O4S/c1-3-30-20-13-18-19(14-21(20)31-4-2)25-24(32)27(23(18)29)15-16-7-9-17(10-8-16)22(28)26-11-5-6-12-26/h7-10,13-14H,3-6,11-12,15H2,1-2H3,(H,25,32)