2-[3-(2,3-dimethylcyclohexyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-methyl-propanamide

Systemtic Name: 2-[3-(2,3-dimethylcyclohexyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-methyl-propanamide Openeye Name: 2-[3-(2,3-dimethylcyclohexyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-methyl-propanamide CAS Name: 2-[[3-(2,3-dimethylcyclohexyl)-4-oxo-2-quinazolinyl]thio]-N-methylpropanamide IUPAC Name: 2-[3-(2,3-dimethylcyclohexyl)-4-oxoquinazolin-2-yl]sulfanyl-N-methylpropanamide Traditional Name: 2-[[3-(2,3-dimethylcyclohexyl)-4-keto-quinazolin-2-yl]thio]-N-methyl-propionamide Formula: C20H27N3O2S MolecularWeight: 373.51228

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)N2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)NC

Isomeric SMILES

CC1CCCC(C1C)N2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)NC

InChI

InChI=1S/C20H27N3O2S/c1-12-8-7-11-17(13(12)2)23-19(25)15-9-5-6-10-16(15)22-20(23)26-14(3)18(24)21-4/h5-6,9-10,12-14,17H,7-8,11H2,1-4H3,(H,21,24)