7-chloranyl-3-(2-methylpropyl)-2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-quinazolin-4-one

Systemtic Name: 7-chloranyl-3-(2-methylpropyl)-2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-quinazolin-4-one Openeye Name: 7-chloro-3-isobutyl-2-(2-oxo-2-pyrrolidin-1-yl-ethyl)sulfanyl-quinazolin-4-one CAS Name: 7-chloro-3-(2-methylpropyl)-2-[[2-oxo-2-(1-pyrrolidinyl)ethyl]thio]-4-quinazolinone IUPAC Name: 7-chloro-3-(2-methylpropyl)-2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanylquinazolin-4-one Traditional Name: 7-chloro-3-isobutyl-2-[(2-keto-2-pyrrolidino-ethyl)thio]quinazolin-4-one Formula: C18H22ClN3O2S MolecularWeight: 379.90418

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC(=O)N3CCCC3

Isomeric SMILES

CC(C)CN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC(=O)N3CCCC3

InChI

InChI=1S/C18H22ClN3O2S/c1-12(2)10-22-17(24)14-6-5-13(19)9-15(14)20-18(22)25-11-16(23)21-7-3-4-8-21/h5-6,9,12H,3-4,7-8,10-11H2,1-2H3