2-[3-(3-methoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(phenylmethyl)butanamide

Systemtic Name: 2-[3-(3-methoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(phenylmethyl)butanamide Openeye Name: N-benzyl-2-[3-(3-methoxyphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-butanamide CAS Name: 2-[[3-(3-methoxyphenyl)-4-oxo-2-quinazolinyl]thio]-N-(phenylmethyl)butanamide IUPAC Name: N-benzyl-2-[3-(3-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylbutanamide Traditional Name: N-benzyl-2-[[4-keto-3-(3-methoxyphenyl)quinazolin-2-yl]thio]butyramide Formula: C26H25N3O3S MolecularWeight: 459.56

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCC1=CC=CC=C1)SC2=NC3=CC=CC=C3C(=O)N2C4=CC(=CC=C4)OC

Isomeric SMILES

CCC(C(=O)NCC1=CC=CC=C1)SC2=NC3=CC=CC=C3C(=O)N2C4=CC(=CC=C4)OC

InChI

InChI=1S/C26H25N3O3S/c1-3-23(24(30)27-17-18-10-5-4-6-11-18)33-26-28-22-15-8-7-14-21(22)25(31)29(26)19-12-9-13-20(16-19)32-2/h4-16,23H,3,17H2,1-2H3,(H,27,30)