N-(4-methoxyphenyl)-3-methyl-2-[4-oxidanylidene-3-(3-propan-2-yloxypropyl)quinazolin-2-yl]sulfanyl-butanamide

Systemtic Name: N-(4-methoxyphenyl)-3-methyl-2-[4-oxidanylidene-3-(3-propan-2-yloxypropyl)quinazolin-2-yl]sulfanyl-butanamide Openeye Name: 2-[3-(3-isopropoxypropyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(4-methoxyphenyl)-3-methyl-butanamide CAS Name: N-(4-methoxyphenyl)-3-methyl-2-[[4-oxo-3-(3-propan-2-yloxypropyl)-2-quinazolinyl]thio]butanamide IUPAC Name: N-(4-methoxyphenyl)-3-methyl-2-[4-oxo-3-(3-propan-2-yloxypropyl)quinazolin-2-yl]sulfanylbutanamide Traditional Name: 2-[[3-(3-isopropoxypropyl)-4-keto-quinazolin-2-yl]thio]-N-(4-methoxyphenyl)-3-methyl-butyramide Formula: C26H33N3O4S MolecularWeight: 483.62292

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CC=C(C=C1)OC)SC2=NC3=CC=CC=C3C(=O)N2CCCOC(C)C

Isomeric SMILES

CC(C)C(C(=O)NC1=CC=C(C=C1)OC)SC2=NC3=CC=CC=C3C(=O)N2CCCOC(C)C

InChI

InChI=1S/C26H33N3O4S/c1-17(2)23(24(30)27-19-11-13-20(32-5)14-12-19)34-26-28-22-10-7-6-9-21(22)25(31)29(26)15-8-16-33-18(3)4/h6-7,9-14,17-18,23H,8,15-16H2,1-5H3,(H,27,30)