N-[3-[(4-chlorophenyl)methyl]-4-oxidanylidene-quinazolin-6-yl]-2-pyridin-4-ylsulfanyl-ethanamide

Systemtic Name: N-[3-[(4-chlorophenyl)methyl]-4-oxidanylidene-quinazolin-6-yl]-2-pyridin-4-ylsulfanyl-ethanamide Openeye Name: N-[3-[(4-chlorophenyl)methyl]-4-oxo-quinazolin-6-yl]-2-(4-pyridylsulfanyl)acetamide CAS Name: N-[3-[(4-chlorophenyl)methyl]-4-oxo-6-quinazolinyl]-2-(pyridin-4-ylthio)acetamide IUPAC Name: N-[3-[(4-chlorophenyl)methyl]-4-oxoquinazolin-6-yl]-2-pyridin-4-ylsulfanylacetamide Traditional Name: N-[3-(4-chlorobenzyl)-4-keto-quinazolin-6-yl]-2-(4-pyridylthio)acetamide Formula: C22H17ClN4O2S MolecularWeight: 436.91398

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C=NC3=C(C2=O)C=C(C=C3)NC(=O)CSC4=CC=NC=C4)Cl

Isomeric SMILES

C1=CC(=CC=C1CN2C=NC3=C(C2=O)C=C(C=C3)NC(=O)CSC4=CC=NC=C4)Cl

InChI

InChI=1S/C22H17ClN4O2S/c23-16-3-1-15(2-4-16)12-27-14-25-20-6-5-17(11-19(20)22(27)29)26-21(28)13-30-18-7-9-24-10-8-18/h1-11,14H,12-13H2,(H,26,28)