3-cyclopentyl-2-[2-oxidanylidene-2-(4-pyrrolidin-1-ylsulfonylphenyl)ethyl]sulfanyl-quinazolin-4-one

Systemtic Name: 3-cyclopentyl-2-[2-oxidanylidene-2-(4-pyrrolidin-1-ylsulfonylphenyl)ethyl]sulfanyl-quinazolin-4-one Openeye Name: 3-cyclopentyl-2-[2-oxo-2-(4-pyrrolidin-1-ylsulfonylphenyl)ethyl]sulfanyl-quinazolin-4-one CAS Name: 3-cyclopentyl-2-[[2-oxo-2-[4-(1-pyrrolidinylsulfonyl)phenyl]ethyl]thio]-4-quinazolinone IUPAC Name: 3-cyclopentyl-2-[2-oxo-2-(4-pyrrolidin-1-ylsulfonylphenyl)ethyl]sulfanylquinazolin-4-one Traditional Name: 3-cyclopentyl-2-[[2-keto-2-(4-pyrrolidinosulfonylphenyl)ethyl]thio]quinazolin-4-one Formula: C25H27N3O4S2 MolecularWeight: 497.62958

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCCC5

Isomeric SMILES

C1CCC(C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCCC5

InChI

InChI=1S/C25H27N3O4S2/c29-23(18-11-13-20(14-12-18)34(31,32)27-15-5-6-16-27)17-33-25-26-22-10-4-3-9-21(22)24(30)28(25)19-7-1-2-8-19/h3-4,9-14,19H,1-2,5-8,15-17H2