1-[6-[(3S)-3-azanylpiperidin-1-yl]pyrimidin-4-yl]-5,6-dimethyl-benzimidazol-2-amine

Systemtic Name: 1-[6-[(3S)-3-azanylpiperidin-1-yl]pyrimidin-4-yl]-5,6-dimethyl-benzimidazol-2-amine Openeye Name: 1-[6-[(3S)-3-amino-1-piperidyl]pyrimidin-4-yl]-5,6-dimethyl-benzimidazol-2-amine CAS Name: 1-[6-[(3S)-3-amino-1-piperidinyl]-4-pyrimidinyl]-5,6-dimethyl-2-benzimidazolamine IUPAC Name: 1-[6-[(3S)-3-aminopiperidin-1-yl]pyrimidin-4-yl]-5,6-dimethylbenzimidazol-2-amine Traditional Name: [(3S)-1-[6-(2-amino-5,6-dimethyl-benzimidazol-1-yl)pyrimidin-4-yl]-3-piperidyl]amine Formula: C18H23N7 MolecularWeight: 337.42212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N(C(=N2)N)C3=CC(=NC=N3)N4CCCC(C4)N

Isomeric SMILES

CC1=CC2=C(C=C1C)N(C(=N2)N)C3=CC(=NC=N3)N4CCC[C@@H](C4)N

InChI

InChI=1S/C18H23N7/c1-11-6-14-15(7-12(11)2)25(18(20)23-14)17-8-16(21-10-22-17)24-5-3-4-13(19)9-24/h6-8,10,13H,3-5,9,19H2,1-2H3,(H2,20,23)/t13-/m0/s1