5-(4-methoxyphenyl)sulfanyl-6-methyl-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine

Systemtic Name: 5-(4-methoxyphenyl)sulfanyl-6-methyl-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine Openeye Name: 5-(4-methoxyphenyl)sulfanyl-6-methyl-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine CAS Name: 5-[(4-methoxyphenyl)thio]-6-methyl-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine IUPAC Name: 5-(4-methoxyphenyl)sulfanyl-6-methyl-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine Traditional Name: [2-amino-5-[(4-methoxyphenyl)thio]-6-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]amine Formula: C14H15N5OS MolecularWeight: 301.3668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1)N=C(N=C2N)N)SC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(C2=C(N1)N=C(N=C2N)N)SC3=CC=C(C=C3)OC

InChI

InChI=1S/C14H15N5OS/c1-7-11(21-9-5-3-8(20-2)4-6-9)10-12(15)18-14(16)19-13(10)17-7/h3-6H,1-2H3,(H5,15,16,17,18,19)