N-cyclopentyl-4-[[2-(3-methylbutylsulfanyl)-4-oxidanylidene-quinazolin-3-yl]methyl]benzamide

Systemtic Name: N-cyclopentyl-4-[[2-(3-methylbutylsulfanyl)-4-oxidanylidene-quinazolin-3-yl]methyl]benzamide Openeye Name: N-cyclopentyl-4-[(2-isopentylsulfanyl-4-oxo-quinazolin-3-yl)methyl]benzamide CAS Name: N-cyclopentyl-4-[[2-(3-methylbutylthio)-4-oxo-3-quinazolinyl]methyl]benzamide IUPAC Name: N-cyclopentyl-4-[[2-(3-methylbutylsulfanyl)-4-oxoquinazolin-3-yl]methyl]benzamide Traditional Name: N-cyclopentyl-4-[[2-(isoamylthio)-4-keto-quinazolin-3-yl]methyl]benzamide Formula: C26H31N3O2S MolecularWeight: 449.60824

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCSC1=NC2=CC=CC=C2C(=O)N1CC3=CC=C(C=C3)C(=O)NC4CCCC4

Isomeric SMILES

CC(C)CCSC1=NC2=CC=CC=C2C(=O)N1CC3=CC=C(C=C3)C(=O)NC4CCCC4

InChI

InChI=1S/C26H31N3O2S/c1-18(2)15-16-32-26-28-23-10-6-5-9-22(23)25(31)29(26)17-19-11-13-20(14-12-19)24(30)27-21-7-3-4-8-21/h5-6,9-14,18,21H,3-4,7-8,15-17H2,1-2H3,(H,27,30)