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

Systemtic Name: N-(3-methoxyphenyl)-2-[4-oxidanylidene-3-(3-oxidanylpropyl)quinazolin-2-yl]sulfanyl-2-phenyl-ethanamide Openeye Name: 2-[3-(3-hydroxypropyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(3-methoxyphenyl)-2-phenyl-acetamide CAS Name: 2-[[3-(3-hydroxypropyl)-4-oxo-2-quinazolinyl]thio]-N-(3-methoxyphenyl)-2-phenylacetamide IUPAC Name: 2-[3-(3-hydroxypropyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(3-methoxyphenyl)-2-phenylacetamide Traditional Name: 2-[[3-(3-hydroxypropyl)-4-keto-quinazolin-2-yl]thio]-N-(3-methoxyphenyl)-2-phenyl-acetamide Formula: C26H25N3O4S MolecularWeight: 475.5594

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)C(C2=CC=CC=C2)SC3=NC4=CC=CC=C4C(=O)N3CCCO

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)C(C2=CC=CC=C2)SC3=NC4=CC=CC=C4C(=O)N3CCCO

InChI

InChI=1S/C26H25N3O4S/c1-33-20-12-7-11-19(17-20)27-24(31)23(18-9-3-2-4-10-18)34-26-28-22-14-6-5-13-21(22)25(32)29(26)15-8-16-30/h2-7,9-14,17,23,30H,8,15-16H2,1H3,(H,27,31)