3-cyclohexyl-2-(3,3-dimethyl-2-oxidanylidene-butyl)sulfanyl-7-piperidin-1-ylcarbonyl-quinazolin-4-one

Systemtic Name: 3-cyclohexyl-2-(3,3-dimethyl-2-oxidanylidene-butyl)sulfanyl-7-piperidin-1-ylcarbonyl-quinazolin-4-one Openeye Name: 3-cyclohexyl-2-(3,3-dimethyl-2-oxo-butyl)sulfanyl-7-(piperidine-1-carbonyl)quinazolin-4-one CAS Name: 3-cyclohexyl-2-[(3,3-dimethyl-2-oxobutyl)thio]-7-[oxo(1-piperidinyl)methyl]-4-quinazolinone IUPAC Name: 3-cyclohexyl-2-(3,3-dimethyl-2-oxobutyl)sulfanyl-7-(piperidine-1-carbonyl)quinazolin-4-one Traditional Name: 3-cyclohexyl-2-[(2-keto-3,3-dimethyl-butyl)thio]-7-(piperidine-1-carbonyl)quinazolin-4-one Formula: C26H35N3O3S MolecularWeight: 469.6394

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CSC1=NC2=C(C=CC(=C2)C(=O)N3CCCCC3)C(=O)N1C4CCCCC4

Isomeric SMILES

CC(C)(C)C(=O)CSC1=NC2=C(C=CC(=C2)C(=O)N3CCCCC3)C(=O)N1C4CCCCC4

InChI

InChI=1S/C26H35N3O3S/c1-26(2,3)22(30)17-33-25-27-21-16-18(23(31)28-14-8-5-9-15-28)12-13-20(21)24(32)29(25)19-10-6-4-7-11-19/h12-13,16,19H,4-11,14-15,17H2,1-3H3