3-[3-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]-3-oxidanylidene-propyl]-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 3-[3-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]-3-oxidanylidene-propyl]-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-[3-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]-3-oxo-propyl]-2-thioxo-1H-quinazolin-4-one CAS Name: 3-[3-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-pyrrolidinyl]-3-oxopropyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-[3-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]-3-oxopropyl]-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-[3-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidino]-3-keto-propyl]-2-thioxo-1H-quinazolin-4-one Formula: C23H23N3O4S MolecularWeight: 437.51142

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CCN2C(=O)C3=CC=CC=C3NC2=S)C4=CC5=C(C=C4)OCCO5

Isomeric SMILES

C1CC(N(C1)C(=O)CCN2C(=O)C3=CC=CC=C3NC2=S)C4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C23H23N3O4S/c27-21(9-11-26-22(28)16-4-1-2-5-17(16)24-23(26)31)25-10-3-6-18(25)15-7-8-19-20(14-15)30-13-12-29-19/h1-2,4-5,7-8,14,18H,3,6,9-13H2,(H,24,31)