ethyl 4-[4-[4-(1H-indazol-5-ylamino)-6-methoxy-1,3,5-triazin-2-yl]piperazin-1-yl]-2-methylsulfanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-[4-[4-(1H-indazol-5-ylamino)-6-methoxy-1,3,5-triazin-2-yl]piperazin-1-yl]-2-methylsulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-[4-[4-(1H-indazol-5-ylamino)-6-methoxy-1,3,5-triazin-2-yl]piperazin-1-yl]-2-methylsulfanyl-pyrimidine-5-carboxylate CAS Name: 4-[4-[4-(1H-indazol-5-ylamino)-6-methoxy-1,3,5-triazin-2-yl]-1-piperazinyl]-2-(methylthio)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-[4-(1H-indazol-5-ylamino)-6-methoxy-1,3,5-triazin-2-yl]piperazin-1-yl]-2-methylsulfanylpyrimidine-5-carboxylate Traditional Name: 4-[4-[4-(1H-indazol-5-ylamino)-6-methoxy-s-triazin-2-yl]piperazino]-2-(methylthio)pyrimidine-5-carboxylic acid ethyl ester Formula: C23H26N10O3S MolecularWeight: 522.58274

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1N2CCN(CC2)C3=NC(=NC(=N3)OC)NC4=CC5=C(C=C4)NN=C5)SC

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1N2CCN(CC2)C3=NC(=NC(=N3)OC)NC4=CC5=C(C=C4)NN=C5)SC

InChI

InChI=1S/C23H26N10O3S/c1-4-36-19(34)16-13-24-23(37-3)27-18(16)32-7-9-33(10-8-32)21-28-20(29-22(30-21)35-2)26-15-5-6-17-14(11-15)12-25-31-17/h5-6,11-13H,4,7-10H2,1-3H3,(H,25,31)(H,26,28,29,30)