2-[3-[(2S)-butan-2-yl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(cyclohexen-1-yl)-N-cyclopropyl-ethanamide

Systemtic Name: 2-[3-[(2S)-butan-2-yl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(cyclohexen-1-yl)-N-cyclopropyl-ethanamide Openeye Name: N-(cyclohexen-1-yl)-N-cyclopropyl-2-[3-[(1S)-1-methylpropyl]-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: 2-[[3-[(2S)-butan-2-yl]-4-oxo-2-quinazolinyl]thio]-N-(1-cyclohexenyl)-N-cyclopropylacetamide IUPAC Name: 2-[3-[(2S)-butan-2-yl]-4-oxoquinazolin-2-yl]sulfanyl-N-(cyclohexen-1-yl)-N-cyclopropylacetamide Traditional Name: N-(cyclohexen-1-yl)-N-cyclopropyl-2-[[4-keto-3-[(1S)-1-methylpropyl]quinazolin-2-yl]thio]acetamide Formula: C23H29N3O2S MolecularWeight: 411.56026

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=O)C2=CC=CC=C2N=C1SCC(=O)N(C3CC3)C4=CCCCC4

Isomeric SMILES

CC[C@H](C)N1C(=O)C2=CC=CC=C2N=C1SCC(=O)N(C3CC3)C4=CCCCC4

InChI

InChI=1S/C23H29N3O2S/c1-3-16(2)25-22(28)19-11-7-8-12-20(19)24-23(25)29-15-21(27)26(18-13-14-18)17-9-5-4-6-10-17/h7-9,11-12,16,18H,3-6,10,13-15H2,1-2H3/t16-/m0/s1