2-azanyl-5-(2,6-dimethylphenyl)sulfanyl-6-ethyl-1,7-dihydropyrrolo[2,3-d]pyrimidin-4-one

Systemtic Name: 2-azanyl-5-(2,6-dimethylphenyl)sulfanyl-6-ethyl-1,7-dihydropyrrolo[2,3-d]pyrimidin-4-one Openeye Name: 2-amino-5-(2,6-dimethylphenyl)sulfanyl-6-ethyl-1,7-dihydropyrrolo[2,3-d]pyrimidin-4-one CAS Name: 2-amino-5-[(2,6-dimethylphenyl)thio]-6-ethyl-1,7-dihydropyrrolo[2,3-d]pyrimidin-4-one IUPAC Name: 2-amino-5-(2,6-dimethylphenyl)sulfanyl-6-ethyl-1,7-dihydropyrrolo[2,3-d]pyrimidin-4-one Traditional Name: 2-amino-5-[(2,6-dimethylphenyl)thio]-6-ethyl-1,7-dihydropyrrolo[2,3-d]pyrimidin-4-one Formula: C16H18N4OS MolecularWeight: 314.40532

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(N1)NC(=NC2=O)N)SC3=C(C=CC=C3C)C

Isomeric SMILES

CCC1=C(C2=C(N1)NC(=NC2=O)N)SC3=C(C=CC=C3C)C

InChI

InChI=1S/C16H18N4OS/c1-4-10-13(22-12-8(2)6-5-7-9(12)3)11-14(18-10)19-16(17)20-15(11)21/h5-7H,4H2,1-3H3,(H4,17,18,19,20,21)