2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-3-(phenylmethyl)quinazolin-4-one

Systemtic Name: 2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-3-(phenylmethyl)quinazolin-4-one Openeye Name: 3-benzyl-2-(2-oxo-2-pyrrolidin-1-yl-ethyl)sulfanyl-quinazolin-4-one CAS Name: 2-[[2-oxo-2-(1-pyrrolidinyl)ethyl]thio]-3-(phenylmethyl)-4-quinazolinone IUPAC Name: 3-benzyl-2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanylquinazolin-4-one Traditional Name: 3-benzyl-2-[(2-keto-2-pyrrolidino-ethyl)thio]quinazolin-4-one Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC4=CC=CC=C4

InChI

InChI=1S/C21H21N3O2S/c25-19(23-12-6-7-13-23)15-27-21-22-18-11-5-4-10-17(18)20(26)24(21)14-16-8-2-1-3-9-16/h1-5,8-11H,6-7,12-15H2