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

Systemtic Name: N-[(4-chlorophenyl)methyl]-2-[4-oxidanylidene-3-(pyridin-4-ylmethyl)quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-[(4-chlorophenyl)methyl]-2-[4-oxo-3-(4-pyridylmethyl)quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-[(4-chlorophenyl)methyl]-2-[[4-oxo-3-(pyridin-4-ylmethyl)-2-quinazolinyl]thio]acetamide IUPAC Name: N-[(4-chlorophenyl)methyl]-2-[4-oxo-3-(pyridin-4-ylmethyl)quinazolin-2-yl]sulfanylacetamide Traditional Name: N-(4-chlorobenzyl)-2-[[4-keto-3-(4-pyridylmethyl)quinazolin-2-yl]thio]acetamide Formula: C23H19ClN4O2S MolecularWeight: 450.94056

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC(=O)NCC3=CC=C(C=C3)Cl)CC4=CC=NC=C4

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC(=O)NCC3=CC=C(C=C3)Cl)CC4=CC=NC=C4

InChI

InChI=1S/C23H19ClN4O2S/c24-18-7-5-16(6-8-18)13-26-21(29)15-31-23-27-20-4-2-1-3-19(20)22(30)28(23)14-17-9-11-25-12-10-17/h1-12H,13-15H2,(H,26,29)