N4-(1H-indazol-5-yl)-N2-(1-methylbenzimidazol-2-yl)thieno[3,2-d]pyrimidine-2,4-diamine

Systemtic Name: N4-(1H-indazol-5-yl)-N2-(1-methylbenzimidazol-2-yl)thieno[3,2-d]pyrimidine-2,4-diamine Openeye Name: N4-(1H-indazol-5-yl)-N2-(1-methylbenzimidazol-2-yl)thieno[3,2-d]pyrimidine-2,4-diamine CAS Name: N4-(1H-indazol-5-yl)-N2-(1-methyl-2-benzimidazolyl)thieno[3,2-d]pyrimidine-2,4-diamine IUPAC Name: 4-N-(1H-indazol-5-yl)-2-N-(1-methylbenzimidazol-2-yl)thieno[3,2-d]pyrimidine-2,4-diamine Traditional Name: 1H-indazol-5-yl-[2-[(1-methylbenzimidazol-2-yl)amino]thieno[3,2-d]pyrimidin-4-yl]amine Formula: C21H16N8S MolecularWeight: 412.47034

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1NC3=NC4=C(C(=N3)NC5=CC6=C(C=C5)NN=C6)SC=C4

Isomeric SMILES

CN1C2=CC=CC=C2N=C1NC3=NC4=C(C(=N3)NC5=CC6=C(C=C5)NN=C6)SC=C4

InChI

InChI=1S/C21H16N8S/c1-29-17-5-3-2-4-15(17)25-21(29)27-20-24-16-8-9-30-18(16)19(26-20)23-13-6-7-14-12(10-13)11-22-28-14/h2-11H,1H3,(H,22,28)(H2,23,24,25,26,27)