2-(3-butyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-[(1R)-1-phenylbutyl]ethanamide

Systemtic Name: 2-(3-butyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-[(1R)-1-phenylbutyl]ethanamide Openeye Name: 2-(3-butyl-4-oxo-quinazolin-2-yl)sulfanyl-N-[(1R)-1-phenylbutyl]acetamide CAS Name: 2-[(3-butyl-4-oxo-2-quinazolinyl)thio]-N-[(1R)-1-phenylbutyl]acetamide IUPAC Name: 2-(3-butyl-4-oxoquinazolin-2-yl)sulfanyl-N-[(1R)-1-phenylbutyl]acetamide Traditional Name: 2-[(3-butyl-4-keto-quinazolin-2-yl)thio]-N-[(1R)-1-phenylbutyl]acetamide Formula: C24H29N3O2S MolecularWeight: 423.57096

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC(CCC)C3=CC=CC=C3

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)N[C@H](CCC)C3=CC=CC=C3

InChI

InChI=1S/C24H29N3O2S/c1-3-5-16-27-23(29)19-14-9-10-15-21(19)26-24(27)30-17-22(28)25-20(11-4-2)18-12-7-6-8-13-18/h6-10,12-15,20H,3-5,11,16-17H2,1-2H3,(H,25,28)/t20-/m1/s1