N-[(3R)-1,1-bis(oxidanylidene)-2,3-dihydrothiophen-3-yl]-N-phenyl-2-quinazolin-4-ylsulfanyl-ethanamide

Systemtic Name: N-[(3R)-1,1-bis(oxidanylidene)-2,3-dihydrothiophen-3-yl]-N-phenyl-2-quinazolin-4-ylsulfanyl-ethanamide Openeye Name: N-[(3R)-1,1-dioxo-2,3-dihydrothiophen-3-yl]-N-phenyl-2-quinazolin-4-ylsulfanyl-acetamide CAS Name: N-[(3R)-1,1-dioxo-2,3-dihydrothiophen-3-yl]-N-phenyl-2-(4-quinazolinylthio)acetamide IUPAC Name: N-[(3R)-1,1-dioxo-2,3-dihydrothiophen-3-yl]-N-phenyl-2-quinazolin-4-ylsulfanylacetamide Traditional Name: N-[(3R)-1,1-diketo-2,3-dihydrothiophen-3-yl]-N-phenyl-2-(quinazolin-4-ylthio)acetamide Formula: C20H17N3O3S2 MolecularWeight: 411.49728

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C=CS1(=O)=O)N(C2=CC=CC=C2)C(=O)CSC3=NC=NC4=CC=CC=C43

Isomeric SMILES

C1[C@@H](C=CS1(=O)=O)N(C2=CC=CC=C2)C(=O)CSC3=NC=NC4=CC=CC=C43

InChI

InChI=1S/C20H17N3O3S2/c24-19(12-27-20-17-8-4-5-9-18(17)21-14-22-20)23(15-6-2-1-3-7-15)16-10-11-28(25,26)13-16/h1-11,14,16H,12-13H2/t16-/m1/s1