2-[4-oxidanylidene-3-(3-oxidanylpropyl)quinazolin-2-yl]sulfanyl-N-phenyl-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[4-oxidanylidene-3-(3-oxidanylpropyl)quinazolin-2-yl]sulfanyl-N-phenyl-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[3-(3-hydroxypropyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-phenyl-acetamide CAS Name: 2-[[3-(3-hydroxypropyl)-4-oxo-2-quinazolinyl]thio]-N-phenyl-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[3-(3-hydroxypropyl)-4-oxoquinazolin-2-yl]sulfanyl-N-phenylacetamide Traditional Name: N-benzyl-2-[[3-(3-hydroxypropyl)-4-keto-quinazolin-2-yl]thio]-N-phenyl-acetamide Formula: C26H25N3O3S MolecularWeight: 459.56

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(C2=CC=CC=C2)C(=O)CSC3=NC4=CC=CC=C4C(=O)N3CCCO

Isomeric SMILES

C1=CC=C(C=C1)CN(C2=CC=CC=C2)C(=O)CSC3=NC4=CC=CC=C4C(=O)N3CCCO

InChI

InChI=1S/C26H25N3O3S/c30-17-9-16-28-25(32)22-14-7-8-15-23(22)27-26(28)33-19-24(31)29(21-12-5-2-6-13-21)18-20-10-3-1-4-11-20/h1-8,10-15,30H,9,16-19H2