N2-(3-methylphenyl)-N4-(3-pyrrolidin-1-ylpropyl)pyrimidine-2,4-diamine

Systemtic Name: N2-(3-methylphenyl)-N4-(3-pyrrolidin-1-ylpropyl)pyrimidine-2,4-diamine Openeye Name: N2-(m-tolyl)-N4-(3-pyrrolidin-1-ylpropyl)pyrimidine-2,4-diamine CAS Name: N2-(3-methylphenyl)-N4-[3-(1-pyrrolidinyl)propyl]pyrimidine-2,4-diamine IUPAC Name: 2-N-(3-methylphenyl)-4-N-(3-pyrrolidin-1-ylpropyl)pyrimidine-2,4-diamine Traditional Name: [2-(m-toluidino)pyrimidin-4-yl]-(3-pyrrolidinopropyl)amine Formula: C18H25N5 MolecularWeight: 311.4246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NC=CC(=N2)NCCCN3CCCC3

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NC=CC(=N2)NCCCN3CCCC3

InChI

InChI=1S/C18H25N5/c1-15-6-4-7-16(14-15)21-18-20-10-8-17(22-18)19-9-5-13-23-11-2-3-12-23/h4,6-8,10,14H,2-3,5,9,11-13H2,1H3,(H2,19,20,21,22)