2-(3-butyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-[(2-methylphenyl)methyl]ethanamide

Systemtic Name: 2-(3-butyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-[(2-methylphenyl)methyl]ethanamide Openeye Name: 2-(3-butyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(o-tolylmethyl)acetamide CAS Name: 2-[(3-butyl-4-oxo-2-quinazolinyl)thio]-N-[(2-methylphenyl)methyl]acetamide IUPAC Name: 2-(3-butyl-4-oxoquinazolin-2-yl)sulfanyl-N-[(2-methylphenyl)methyl]acetamide Traditional Name: 2-[(3-butyl-4-keto-quinazolin-2-yl)thio]-N-(2-methylbenzyl)acetamide Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NCC3=CC=CC=C3C

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NCC3=CC=CC=C3C

InChI

InChI=1S/C22H25N3O2S/c1-3-4-13-25-21(27)18-11-7-8-12-19(18)24-22(25)28-15-20(26)23-14-17-10-6-5-9-16(17)2/h5-12H,3-4,13-15H2,1-2H3,(H,23,26)