2-[3-[(2R)-1-methoxypropan-2-yl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[(1S,2S)-2-methylcyclohexyl]ethanamide

Systemtic Name: 2-[3-[(2R)-1-methoxypropan-2-yl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[(1S,2S)-2-methylcyclohexyl]ethanamide Openeye Name: 2-[3-[(1R)-2-methoxy-1-methyl-ethyl]-4-oxo-quinazolin-2-yl]sulfanyl-N-[(1S,2S)-2-methylcyclohexyl]acetamide CAS Name: 2-[[3-[(2R)-1-methoxypropan-2-yl]-4-oxo-2-quinazolinyl]thio]-N-[(1S,2S)-2-methylcyclohexyl]acetamide IUPAC Name: 2-[3-[(2R)-1-methoxypropan-2-yl]-4-oxoquinazolin-2-yl]sulfanyl-N-[(1S,2S)-2-methylcyclohexyl]acetamide Traditional Name: 2-[[4-keto-3-[(1R)-2-methoxy-1-methyl-ethyl]quinazolin-2-yl]thio]-N-[(1S,2S)-2-methylcyclohexyl]acetamide Formula: C21H29N3O3S MolecularWeight: 403.53826

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C(C)COC

Isomeric SMILES

C[C@H]1CCCC[C@@H]1NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2[C@H](C)COC

InChI

InChI=1S/C21H29N3O3S/c1-14-8-4-6-10-17(14)22-19(25)13-28-21-23-18-11-7-5-9-16(18)20(26)24(21)15(2)12-27-3/h5,7,9,11,14-15,17H,4,6,8,10,12-13H2,1-3H3,(H,22,25)/t14-,15+,17-/m0/s1