2-(3-cyclohexyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-pentan-3-yl-ethanamide

Systemtic Name: 2-(3-cyclohexyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-pentan-3-yl-ethanamide Openeye Name: 2-(3-cyclohexyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(1-ethylpropyl)acetamide CAS Name: 2-[(3-cyclohexyl-4-oxo-2-quinazolinyl)thio]-N-pentan-3-ylacetamide IUPAC Name: 2-(3-cyclohexyl-4-oxoquinazolin-2-yl)sulfanyl-N-pentan-3-ylacetamide Traditional Name: 2-[(3-cyclohexyl-4-keto-quinazolin-2-yl)thio]-N-(1-ethylpropyl)acetamide Formula: C21H29N3O2S MolecularWeight: 387.53886

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C3CCCCC3

Isomeric SMILES

CCC(CC)NC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C3CCCCC3

InChI

InChI=1S/C21H29N3O2S/c1-3-15(4-2)22-19(25)14-27-21-23-18-13-9-8-12-17(18)20(26)24(21)16-10-6-5-7-11-16/h8-9,12-13,15-16H,3-7,10-11,14H2,1-2H3,(H,22,25)