2-butylsulfanyl-6-ethylsulfanyl-4-oxidanylidene-3-phenyl-7H-pyrrolo[2,3-d]pyrimidine-5-carboxamide

Systemtic Name: 2-butylsulfanyl-6-ethylsulfanyl-4-oxidanylidene-3-phenyl-7H-pyrrolo[2,3-d]pyrimidine-5-carboxamide Openeye Name: 2-butylsulfanyl-6-ethylsulfanyl-4-oxo-3-phenyl-7H-pyrrolo[2,3-d]pyrimidine-5-carboxamide CAS Name: 2-(butylthio)-6-(ethylthio)-4-oxo-3-phenyl-7H-pyrrolo[2,3-d]pyrimidine-5-carboxamide IUPAC Name: 2-butylsulfanyl-6-ethylsulfanyl-4-oxo-3-phenyl-7H-pyrrolo[2,3-d]pyrimidine-5-carboxamide Traditional Name: 2-(butylthio)-6-(ethylthio)-4-keto-3-phenyl-7H-pyrrolo[2,3-d]pyrimidine-5-carboxamide Formula: C19H22N4O2S2 MolecularWeight: 402.53358

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NC2=C(C(=C(N2)SCC)C(=O)N)C(=O)N1C3=CC=CC=C3

Isomeric SMILES

CCCCSC1=NC2=C(C(=C(N2)SCC)C(=O)N)C(=O)N1C3=CC=CC=C3

InChI

InChI=1S/C19H22N4O2S2/c1-3-5-11-27-19-22-16-14(13(15(20)24)17(21-16)26-4-2)18(25)23(19)12-9-7-6-8-10-12/h6-10,21H,3-5,11H2,1-2H3,(H2,20,24)