N1,N3-dimethyl-5-[[(2-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]methyl]benzene-1,3-diamine

Systemtic Name: N1,N3-dimethyl-5-[[(2-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]methyl]benzene-1,3-diamine Openeye Name: N1,N3-dimethyl-5-[[(2-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]methyl]benzene-1,3-diamine CAS Name: N1,N3-dimethyl-5-[[(2-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]methyl]benzene-1,3-diamine IUPAC Name: 1-N,3-N-dimethyl-5-[[(2-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]methyl]benzene-1,3-diamine Traditional Name: [3,5-bis(methylamino)benzyl]-(2-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amine Formula: C16H20N6 MolecularWeight: 296.3702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CN2)C(=N1)NCC3=CC(=CC(=C3)NC)NC

Isomeric SMILES

CC1=NC2=C(C=CN2)C(=N1)NCC3=CC(=CC(=C3)NC)NC

InChI

InChI=1S/C16H20N6/c1-10-21-15-14(4-5-19-15)16(22-10)20-9-11-6-12(17-2)8-13(7-11)18-3/h4-8,17-18H,9H2,1-3H3,(H2,19,20,21,22)