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

Systemtic Name: 2-[3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[(1R)-1-phenylethyl]ethanamide Openeye Name: 2-(3-isobutyl-4-oxo-quinazolin-2-yl)sulfanyl-N-[(1R)-1-phenylethyl]acetamide CAS Name: 2-[[3-(2-methylpropyl)-4-oxo-2-quinazolinyl]thio]-N-[(1R)-1-phenylethyl]acetamide IUPAC Name: 2-[3-(2-methylpropyl)-4-oxoquinazolin-2-yl]sulfanyl-N-[(1R)-1-phenylethyl]acetamide Traditional Name: 2-[(3-isobutyl-4-keto-quinazolin-2-yl)thio]-N-[(1R)-1-phenylethyl]acetamide Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC(C)C3=CC=CC=C3

Isomeric SMILES

C[C@H](C1=CC=CC=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC(C)C

InChI

InChI=1S/C22H25N3O2S/c1-15(2)13-25-21(27)18-11-7-8-12-19(18)24-22(25)28-14-20(26)23-16(3)17-9-5-4-6-10-17/h4-12,15-16H,13-14H2,1-3H3,(H,23,26)/t16-/m1/s1