N-cyclohexyl-2-[3-(3,5-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-methyl-ethanamide

Systemtic Name: N-cyclohexyl-2-[3-(3,5-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-methyl-ethanamide Openeye Name: N-cyclohexyl-2-[3-(3,5-dimethylphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-methyl-acetamide CAS Name: N-cyclohexyl-2-[[3-(3,5-dimethylphenyl)-4-oxo-2-quinazolinyl]thio]-N-methylacetamide IUPAC Name: N-cyclohexyl-2-[3-(3,5-dimethylphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-methylacetamide Traditional Name: N-cyclohexyl-2-[[3-(3,5-dimethylphenyl)-4-keto-quinazolin-2-yl]thio]-N-methyl-acetamide Formula: C25H29N3O2S MolecularWeight: 435.58166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)N(C)C4CCCCC4)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)N(C)C4CCCCC4)C

InChI

InChI=1S/C25H29N3O2S/c1-17-13-18(2)15-20(14-17)28-24(30)21-11-7-8-12-22(21)26-25(28)31-16-23(29)27(3)19-9-5-4-6-10-19/h7-8,11-15,19H,4-6,9-10,16H2,1-3H3