3-[[2-(2H-benzotriazol-5-ylamino)pyrimidin-4-yl]-(1H-indazol-4-yl)amino]propan-1-ol

Systemtic Name: 3-[[2-(2H-benzotriazol-5-ylamino)pyrimidin-4-yl]-(1H-indazol-4-yl)amino]propan-1-ol Openeye Name: 3-[[2-(2H-benzotriazol-5-ylamino)pyrimidin-4-yl]-(1H-indazol-4-yl)amino]propan-1-ol CAS Name: 3-[[2-(2H-benzotriazol-5-ylamino)-4-pyrimidinyl]-(1H-indazol-4-yl)amino]-1-propanol IUPAC Name: 3-[[2-(2H-benzotriazol-5-ylamino)pyrimidin-4-yl]-(1H-indazol-4-yl)amino]propan-1-ol Traditional Name: 3-[[2-(2H-benzotriazol-5-ylamino)pyrimidin-4-yl]-(1H-indazol-4-yl)amino]propan-1-ol Formula: C20H19N9O MolecularWeight: 401.42456

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=NN2)C(=C1)N(CCCO)C3=NC(=NC=C3)NC4=CC5=NNN=C5C=C4

Isomeric SMILES

C1=CC2=C(C=NN2)C(=C1)N(CCCO)C3=NC(=NC=C3)NC4=CC5=NNN=C5C=C4

InChI

InChI=1S/C20H19N9O/c30-10-2-9-29(18-4-1-3-15-14(18)12-22-25-15)19-7-8-21-20(24-19)23-13-5-6-16-17(11-13)27-28-26-16/h1,3-8,11-12,30H,2,9-10H2,(H,22,25)(H,21,23,24)(H,26,27,28)