1-[6-[[3-(aminomethyl)phenyl]methylamino]pyrimidin-4-yl]-5,6-dimethyl-benzimidazol-2-amine

Systemtic Name: 1-[6-[[3-(aminomethyl)phenyl]methylamino]pyrimidin-4-yl]-5,6-dimethyl-benzimidazol-2-amine Openeye Name: 1-[6-[[3-(aminomethyl)phenyl]methylamino]pyrimidin-4-yl]-5,6-dimethyl-benzimidazol-2-amine CAS Name: 1-[6-[[3-(aminomethyl)phenyl]methylamino]-4-pyrimidinyl]-5,6-dimethyl-2-benzimidazolamine IUPAC Name: 1-[6-[[3-(aminomethyl)phenyl]methylamino]pyrimidin-4-yl]-5,6-dimethylbenzimidazol-2-amine Traditional Name: [6-(2-amino-5,6-dimethyl-benzimidazol-1-yl)pyrimidin-4-yl]-[3-(aminomethyl)benzyl]amine Formula: C21H23N7 MolecularWeight: 373.45422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N(C(=N2)N)C3=CC(=NC=N3)NCC4=CC=CC(=C4)CN

Isomeric SMILES

CC1=CC2=C(C=C1C)N(C(=N2)N)C3=CC(=NC=N3)NCC4=CC=CC(=C4)CN

InChI

InChI=1S/C21H23N7/c1-13-6-17-18(7-14(13)2)28(21(23)27-17)20-9-19(25-12-26-20)24-11-16-5-3-4-15(8-16)10-22/h3-9,12H,10-11,22H2,1-2H3,(H2,23,27)(H,24,25,26)