N-cyclohexyl-2-[3-[(4-methylphenyl)methyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide

Systemtic Name: N-cyclohexyl-2-[3-[(4-methylphenyl)methyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide Openeye Name: N-cyclohexyl-2-[4-oxo-3-(p-tolylmethyl)quinazolin-2-yl]sulfanyl-propanamide CAS Name: N-cyclohexyl-2-[[3-[(4-methylphenyl)methyl]-4-oxo-2-quinazolinyl]thio]propanamide IUPAC Name: N-cyclohexyl-2-[3-[(4-methylphenyl)methyl]-4-oxoquinazolin-2-yl]sulfanylpropanamide Traditional Name: N-cyclohexyl-2-[[4-keto-3-(4-methylbenzyl)quinazolin-2-yl]thio]propionamide Formula: C25H29N3O2S MolecularWeight: 435.58166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)NC4CCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)NC4CCCCC4

InChI

InChI=1S/C25H29N3O2S/c1-17-12-14-19(15-13-17)16-28-24(30)21-10-6-7-11-22(21)27-25(28)31-18(2)23(29)26-20-8-4-3-5-9-20/h6-7,10-15,18,20H,3-5,8-9,16H2,1-2H3,(H,26,29)