N-cyclohexyl-N-methyl-2-[4-oxidanylidene-3-(3-oxidanylpropyl)quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-cyclohexyl-N-methyl-2-[4-oxidanylidene-3-(3-oxidanylpropyl)quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-cyclohexyl-2-[3-(3-hydroxypropyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-methyl-acetamide CAS Name: N-cyclohexyl-2-[[3-(3-hydroxypropyl)-4-oxo-2-quinazolinyl]thio]-N-methylacetamide IUPAC Name: N-cyclohexyl-2-[3-(3-hydroxypropyl)-4-oxoquinazolin-2-yl]sulfanyl-N-methylacetamide Traditional Name: N-cyclohexyl-2-[[3-(3-hydroxypropyl)-4-keto-quinazolin-2-yl]thio]-N-methyl-acetamide Formula: C20H27N3O3S MolecularWeight: 389.51168

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCCO

Isomeric SMILES

CN(C1CCCCC1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCCO

InChI

InChI=1S/C20H27N3O3S/c1-22(15-8-3-2-4-9-15)18(25)14-27-20-21-17-11-6-5-10-16(17)19(26)23(20)12-7-13-24/h5-6,10-11,15,24H,2-4,7-9,12-14H2,1H3