N4-(1H-indazol-6-yl)-N2-(4-methylsulfinylphenyl)-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine

Systemtic Name: N4-(1H-indazol-6-yl)-N2-(4-methylsulfinylphenyl)-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine Openeye Name: N4-(1H-indazol-6-yl)-N2-(4-methylsulfinylphenyl)-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine CAS Name: N4-(1H-indazol-6-yl)-N2-(4-methylsulfinylphenyl)-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine IUPAC Name: 4-N-(1H-indazol-6-yl)-2-N-(4-methylsulfinylphenyl)-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine Traditional Name: 1H-indazol-6-yl-[2-(4-methylsulfinylanilino)-7H-pyrrolo[2,3-d]pyrimidin-4-yl]amine Formula: C20H17N7OS MolecularWeight: 403.46028

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)C1=CC=C(C=C1)NC2=NC3=C(C=CN3)C(=N2)NC4=CC5=C(C=C4)C=NN5

Isomeric SMILES

CS(=O)C1=CC=C(C=C1)NC2=NC3=C(C=CN3)C(=N2)NC4=CC5=C(C=C4)C=NN5

InChI

InChI=1S/C20H17N7OS/c1-29(28)15-6-4-13(5-7-15)24-20-25-18-16(8-9-21-18)19(26-20)23-14-3-2-12-11-22-27-17(12)10-14/h2-11H,1H3,(H,22,27)(H3,21,23,24,25,26)