2-azanyl-6-[2-(3,4-dimethoxyphenyl)sulfanylethyl]-1,7-dihydropyrrolo[2,3-d]pyrimidin-4-one

Systemtic Name: 2-azanyl-6-[2-(3,4-dimethoxyphenyl)sulfanylethyl]-1,7-dihydropyrrolo[2,3-d]pyrimidin-4-one Openeye Name: 2-amino-6-[2-(3,4-dimethoxyphenyl)sulfanylethyl]-1,7-dihydropyrrolo[2,3-d]pyrimidin-4-one CAS Name: 2-amino-6-[2-[(3,4-dimethoxyphenyl)thio]ethyl]-1,7-dihydropyrrolo[2,3-d]pyrimidin-4-one IUPAC Name: 2-amino-6-[2-(3,4-dimethoxyphenyl)sulfanylethyl]-1,7-dihydropyrrolo[2,3-d]pyrimidin-4-one Traditional Name: 2-amino-6-[2-[(3,4-dimethoxyphenyl)thio]ethyl]-1,7-dihydropyrrolo[2,3-d]pyrimidin-4-one Formula: C16H18N4O3S MolecularWeight: 346.40412

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)SCCC2=CC3=C(N2)NC(=NC3=O)N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)SCCC2=CC3=C(N2)NC(=NC3=O)N)OC

InChI

InChI=1S/C16H18N4O3S/c1-22-12-4-3-10(8-13(12)23-2)24-6-5-9-7-11-14(18-9)19-16(17)20-15(11)21/h3-4,7-8H,5-6H2,1-2H3,(H4,17,18,19,20,21)