(2S)-N2-[6-(2-azanyl-5,6-dimethyl-benzimidazol-1-yl)pyrimidin-4-yl]-3-methyl-butane-1,2-diamine

Systemtic Name: (2S)-N2-[6-(2-azanyl-5,6-dimethyl-benzimidazol-1-yl)pyrimidin-4-yl]-3-methyl-butane-1,2-diamine Openeye Name: (2S)-N2-[6-(2-amino-5,6-dimethyl-benzimidazol-1-yl)pyrimidin-4-yl]-3-methyl-butane-1,2-diamine CAS Name: (2S)-N2-[6-(2-amino-5,6-dimethyl-1-benzimidazolyl)-4-pyrimidinyl]-3-methylbutane-1,2-diamine IUPAC Name: (2S)-2-N-[6-(2-amino-5,6-dimethylbenzimidazol-1-yl)pyrimidin-4-yl]-3-methylbutane-1,2-diamine Traditional Name: [6-(2-amino-5,6-dimethyl-benzimidazol-1-yl)pyrimidin-4-yl]-[(1S)-1-(aminomethyl)-2-methyl-propyl]amine Formula: C18H25N7 MolecularWeight: 339.438

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H25N7/c1-10(2)14(8-19)23-16-7-17(22-9-21-16)25-15-6-12(4)11(3)5-13(15)24-18(25)20/h5-7,9-10,14H,8,19H2,1-4H3,(H2,20,24)(H,21,22,23)/t14-/m1/s1