2,4-bis(oxidanylidene)-3-phenyl-N-[2-(phenylmethylsulfanyl)ethyl]-1H-quinazoline-7-carboxamide

Systemtic Name: 2,4-bis(oxidanylidene)-3-phenyl-N-[2-(phenylmethylsulfanyl)ethyl]-1H-quinazoline-7-carboxamide Openeye Name: N-(2-benzylsulfanylethyl)-2,4-dioxo-3-phenyl-1H-quinazoline-7-carboxamide CAS Name: 2,4-dioxo-3-phenyl-N-[2-(phenylmethylthio)ethyl]-1H-quinazoline-7-carboxamide IUPAC Name: N-(2-benzylsulfanylethyl)-2,4-dioxo-3-phenyl-1H-quinazoline-7-carboxamide Traditional Name: N-[2-(benzylthio)ethyl]-2,4-diketo-3-phenyl-1H-quinazoline-7-carboxamide Formula: C24H21N3O3S MolecularWeight: 431.50684

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCCNC(=O)C2=CC3=C(C=C2)C(=O)N(C(=O)N3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CSCCNC(=O)C2=CC3=C(C=C2)C(=O)N(C(=O)N3)C4=CC=CC=C4

InChI

InChI=1S/C24H21N3O3S/c28-22(25-13-14-31-16-17-7-3-1-4-8-17)18-11-12-20-21(15-18)26-24(30)27(23(20)29)19-9-5-2-6-10-19/h1-12,15H,13-14,16H2,(H,25,28)(H,26,30)