N-(2-cyanopropan-2-yl)-N-methyl-2-[3-[(4-methylphenyl)methyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(2-cyanopropan-2-yl)-N-methyl-2-[3-[(4-methylphenyl)methyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-(1-cyano-1-methyl-ethyl)-N-methyl-2-[4-oxo-3-(p-tolylmethyl)quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-(2-cyanopropan-2-yl)-N-methyl-2-[[3-[(4-methylphenyl)methyl]-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: N-(2-cyanopropan-2-yl)-N-methyl-2-[3-[(4-methylphenyl)methyl]-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: N-(1-cyano-1-methyl-ethyl)-2-[[4-keto-3-(4-methylbenzyl)quinazolin-2-yl]thio]-N-methyl-acetamide Formula: C23H24N4O2S MolecularWeight: 420.52726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3N=C2SCC(=O)N(C)C(C)(C)C#N

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3N=C2SCC(=O)N(C)C(C)(C)C#N

InChI

InChI=1S/C23H24N4O2S/c1-16-9-11-17(12-10-16)13-27-21(29)18-7-5-6-8-19(18)25-22(27)30-14-20(28)26(4)23(2,3)15-24/h5-12H,13-14H2,1-4H3