2-(3-butyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-cycloheptyl-ethanamide

Systemtic Name: 2-(3-butyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-cycloheptyl-ethanamide Openeye Name: 2-(3-butyl-4-oxo-quinazolin-2-yl)sulfanyl-N-cycloheptyl-acetamide CAS Name: 2-[(3-butyl-4-oxo-2-quinazolinyl)thio]-N-cycloheptylacetamide IUPAC Name: 2-(3-butyl-4-oxoquinazolin-2-yl)sulfanyl-N-cycloheptylacetamide Traditional Name: 2-[(3-butyl-4-keto-quinazolin-2-yl)thio]-N-cycloheptyl-acetamide Formula: C21H29N3O2S MolecularWeight: 387.53886

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3CCCCCC3

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3CCCCCC3

InChI

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