3-(benzotriazol-1-yl)-1-[4-(2-methyl-5-pyridin-4-yl-pyrimidin-4-yl)piperidin-1-yl]propan-1-one

Systemtic Name: 3-(benzotriazol-1-yl)-1-[4-(2-methyl-5-pyridin-4-yl-pyrimidin-4-yl)piperidin-1-yl]propan-1-one Openeye Name: 3-(benzotriazol-1-yl)-1-[4-[2-methyl-5-(4-pyridyl)pyrimidin-4-yl]-1-piperidyl]propan-1-one CAS Name: 3-(1-benzotriazolyl)-1-[4-(2-methyl-5-pyridin-4-yl-4-pyrimidinyl)-1-piperidinyl]-1-propanone IUPAC Name: 3-(benzotriazol-1-yl)-1-[4-(2-methyl-5-pyridin-4-ylpyrimidin-4-yl)piperidin-1-yl]propan-1-one Traditional Name: 3-(benzotriazol-1-yl)-1-[4-[2-methyl-5-(4-pyridyl)pyrimidin-4-yl]piperidino]propan-1-one Formula: C24H25N7O MolecularWeight: 427.5016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=N1)C2CCN(CC2)C(=O)CCN3C4=CC=CC=C4N=N3)C5=CC=NC=C5

Isomeric SMILES

CC1=NC=C(C(=N1)C2CCN(CC2)C(=O)CCN3C4=CC=CC=C4N=N3)C5=CC=NC=C5

InChI

InChI=1S/C24H25N7O/c1-17-26-16-20(18-6-11-25-12-7-18)24(27-17)19-8-13-30(14-9-19)23(32)10-15-31-22-5-3-2-4-21(22)28-29-31/h2-7,11-12,16,19H,8-10,13-15H2,1H3