N-[1-(4-methoxyphenyl)-2-methyl-propyl]-2-[3-(3-methoxypropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-[1-(4-methoxyphenyl)-2-methyl-propyl]-2-[3-(3-methoxypropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-[1-(4-methoxyphenyl)-2-methyl-propyl]-2-[3-(3-methoxypropyl)-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-[1-(4-methoxyphenyl)-2-methylpropyl]-2-[[3-(3-methoxypropyl)-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: N-[1-(4-methoxyphenyl)-2-methylpropyl]-2-[3-(3-methoxypropyl)-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: 2-[[4-keto-3-(3-methoxypropyl)quinazolin-2-yl]thio]-N-[1-(4-methoxyphenyl)-2-methyl-propyl]acetamide Formula: C25H31N3O4S MolecularWeight: 469.59634

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=C(C=C1)OC)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCCOC

Isomeric SMILES

CC(C)C(C1=CC=C(C=C1)OC)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCCOC

InChI

InChI=1S/C25H31N3O4S/c1-17(2)23(18-10-12-19(32-4)13-11-18)27-22(29)16-33-25-26-21-9-6-5-8-20(21)24(30)28(25)14-7-15-31-3/h5-6,8-13,17,23H,7,14-16H2,1-4H3,(H,27,29)