4-oxidanylidene-N,3-bis(phenylmethyl)-2-(pyridin-4-ylmethylsulfanyl)quinazoline-7-carboxamide

Systemtic Name: 4-oxidanylidene-N,3-bis(phenylmethyl)-2-(pyridin-4-ylmethylsulfanyl)quinazoline-7-carboxamide Openeye Name: N,3-dibenzyl-4-oxo-2-(4-pyridylmethylsulfanyl)quinazoline-7-carboxamide CAS Name: 4-oxo-N,3-bis(phenylmethyl)-2-(pyridin-4-ylmethylthio)-7-quinazolinecarboxamide IUPAC Name: N,3-dibenzyl-4-oxo-2-(pyridin-4-ylmethylsulfanyl)quinazoline-7-carboxamide Traditional Name: N,3-dibenzyl-4-keto-2-(4-pyridylmethylthio)quinazoline-7-carboxamide Formula: C29H24N4O2S MolecularWeight: 492.59146

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C2=CC3=C(C=C2)C(=O)N(C(=N3)SCC4=CC=NC=C4)CC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)C2=CC3=C(C=C2)C(=O)N(C(=N3)SCC4=CC=NC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C29H24N4O2S/c34-27(31-18-21-7-3-1-4-8-21)24-11-12-25-26(17-24)32-29(36-20-23-13-15-30-16-14-23)33(28(25)35)19-22-9-5-2-6-10-22/h1-17H,18-20H2,(H,31,34)