N-(3-methylbutylcarbamoyl)-2-[4-oxidanylidene-3-(3-phenylpropyl)quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(3-methylbutylcarbamoyl)-2-[4-oxidanylidene-3-(3-phenylpropyl)quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-(isopentylcarbamoyl)-2-[4-oxo-3-(3-phenylpropyl)quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-[(3-methylbutylamino)-oxomethyl]-2-[[4-oxo-3-(3-phenylpropyl)-2-quinazolinyl]thio]acetamide IUPAC Name: N-(3-methylbutylcarbamoyl)-2-[4-oxo-3-(3-phenylpropyl)quinazolin-2-yl]sulfanylacetamide Traditional Name: N-(isoamylcarbamoyl)-2-[[4-keto-3-(3-phenylpropyl)quinazolin-2-yl]thio]acetamide Formula: C25H30N4O3S MolecularWeight: 466.5957

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)NC(=O)CSC1=NC2=CC=CC=C2C(=O)N1CCCC3=CC=CC=C3

Isomeric SMILES

CC(C)CCNC(=O)NC(=O)CSC1=NC2=CC=CC=C2C(=O)N1CCCC3=CC=CC=C3

InChI

InChI=1S/C25H30N4O3S/c1-18(2)14-15-26-24(32)28-22(30)17-33-25-27-21-13-7-6-12-20(21)23(31)29(25)16-8-11-19-9-4-3-5-10-19/h3-7,9-10,12-13,18H,8,11,14-17H2,1-2H3,(H2,26,28,30,32)