4-[[2-[2-(butylamino)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]methyl]-N-cyclohexyl-benzamide

Systemtic Name: 4-[[2-[2-(butylamino)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]methyl]-N-cyclohexyl-benzamide Openeye Name: 4-[[2-[2-(butylamino)-2-oxo-ethyl]sulfanyl-4-oxo-quinazolin-3-yl]methyl]-N-cyclohexyl-benzamide CAS Name: 4-[[2-[[2-(butylamino)-2-oxoethyl]thio]-4-oxo-3-quinazolinyl]methyl]-N-cyclohexylbenzamide IUPAC Name: 4-[[2-[2-(butylamino)-2-oxoethyl]sulfanyl-4-oxoquinazolin-3-yl]methyl]-N-cyclohexylbenzamide Traditional Name: 4-[[2-[[2-(butylamino)-2-keto-ethyl]thio]-4-keto-quinazolin-3-yl]methyl]-N-cyclohexyl-benzamide Formula: C28H34N4O3S MolecularWeight: 506.65956

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CSC1=NC2=CC=CC=C2C(=O)N1CC3=CC=C(C=C3)C(=O)NC4CCCCC4

Isomeric SMILES

CCCCNC(=O)CSC1=NC2=CC=CC=C2C(=O)N1CC3=CC=C(C=C3)C(=O)NC4CCCCC4

InChI

InChI=1S/C28H34N4O3S/c1-2-3-17-29-25(33)19-36-28-31-24-12-8-7-11-23(24)27(35)32(28)18-20-13-15-21(16-14-20)26(34)30-22-9-5-4-6-10-22/h7-8,11-16,22H,2-6,9-10,17-19H2,1H3,(H,29,33)(H,30,34)