(2R)-2-[3-[(2S)-butan-2-yl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(1-cyanocyclohexyl)-N-methyl-propanamide

Systemtic Name: (2R)-2-[3-[(2S)-butan-2-yl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(1-cyanocyclohexyl)-N-methyl-propanamide Openeye Name: (2R)-N-(1-cyanocyclohexyl)-N-methyl-2-[3-[(1S)-1-methylpropyl]-4-oxo-quinazolin-2-yl]sulfanyl-propanamide CAS Name: (2R)-2-[[3-[(2S)-butan-2-yl]-4-oxo-2-quinazolinyl]thio]-N-(1-cyanocyclohexyl)-N-methylpropanamide IUPAC Name: (2R)-2-[3-[(2S)-butan-2-yl]-4-oxoquinazolin-2-yl]sulfanyl-N-(1-cyanocyclohexyl)-N-methylpropanamide Traditional Name: (2R)-N-(1-cyanocyclohexyl)-2-[[4-keto-3-[(1S)-1-methylpropyl]quinazolin-2-yl]thio]-N-methyl-propionamide Formula: C23H30N4O2S MolecularWeight: 426.5749

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)N(C)C3(CCCCC3)C#N

Isomeric SMILES

CC[C@H](C)N1C(=O)C2=CC=CC=C2N=C1S[C@H](C)C(=O)N(C)C3(CCCCC3)C#N

InChI

InChI=1S/C23H30N4O2S/c1-5-16(2)27-21(29)18-11-7-8-12-19(18)25-22(27)30-17(3)20(28)26(4)23(15-24)13-9-6-10-14-23/h7-8,11-12,16-17H,5-6,9-10,13-14H2,1-4H3/t16-,17+/m0/s1