1-[2-[ethyl-(1-methylsulfonylpiperidin-3-yl)amino]pyrimidin-4-yl]benzimidazol-5-amine

Systemtic Name: 1-[2-[ethyl-(1-methylsulfonylpiperidin-3-yl)amino]pyrimidin-4-yl]benzimidazol-5-amine Openeye Name: 1-[2-[ethyl-(1-methylsulfonyl-3-piperidyl)amino]pyrimidin-4-yl]benzimidazol-5-amine CAS Name: 1-[2-[ethyl-(1-methylsulfonyl-3-piperidinyl)amino]-4-pyrimidinyl]-5-benzimidazolamine IUPAC Name: 1-[2-[ethyl-(1-methylsulfonylpiperidin-3-yl)amino]pyrimidin-4-yl]benzimidazol-5-amine Traditional Name: [4-(5-aminobenzimidazol-1-yl)pyrimidin-2-yl]-ethyl-(1-mesyl-3-piperidyl)amine Formula: C19H25N7O2S MolecularWeight: 415.5125

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1CCCN(C1)S(=O)(=O)C)C2=NC=CC(=N2)N3C=NC4=C3C=CC(=C4)N

Isomeric SMILES

CCN(C1CCCN(C1)S(=O)(=O)C)C2=NC=CC(=N2)N3C=NC4=C3C=CC(=C4)N

InChI

InChI=1S/C19H25N7O2S/c1-3-25(15-5-4-10-24(12-15)29(2,27)28)19-21-9-8-18(23-19)26-13-22-16-11-14(20)6-7-17(16)26/h6-9,11,13,15H,3-5,10,12,20H2,1-2H3