N-cyclohexyl-N-ethyl-2-[3-(5-methylpyridin-2-yl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide

Systemtic Name: N-cyclohexyl-N-ethyl-2-[3-(5-methylpyridin-2-yl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide Openeye Name: N-cyclohexyl-N-ethyl-2-[3-(5-methyl-2-pyridyl)-4-oxo-quinazolin-2-yl]sulfanyl-propanamide CAS Name: N-cyclohexyl-N-ethyl-2-[[3-(5-methyl-2-pyridinyl)-4-oxo-2-quinazolinyl]thio]propanamide IUPAC Name: N-cyclohexyl-N-ethyl-2-[3-(5-methylpyridin-2-yl)-4-oxoquinazolin-2-yl]sulfanylpropanamide Traditional Name: N-cyclohexyl-N-ethyl-2-[[4-keto-3-(5-methyl-2-pyridyl)quinazolin-2-yl]thio]propionamide Formula: C25H30N4O2S MolecularWeight: 450.5963

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1CCCCC1)C(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2C4=NC=C(C=C4)C

Isomeric SMILES

CCN(C1CCCCC1)C(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2C4=NC=C(C=C4)C

InChI

InChI=1S/C25H30N4O2S/c1-4-28(19-10-6-5-7-11-19)23(30)18(3)32-25-27-21-13-9-8-12-20(21)24(31)29(25)22-15-14-17(2)16-26-22/h8-9,12-16,18-19H,4-7,10-11H2,1-3H3