N2-[bis(aziridin-1-yl)phosphoryl]-N4-methyl-N4-(phenylmethyl)pyrimidine-2,4-diamine

Systemtic Name: N2-[bis(aziridin-1-yl)phosphoryl]-N4-methyl-N4-(phenylmethyl)pyrimidine-2,4-diamine Openeye Name: N4-benzyl-N2-[bis(aziridin-1-yl)phosphoryl]-N4-methyl-pyrimidine-2,4-diamine CAS Name: N2-[bis(1-aziridinyl)phosphoryl]-N4-methyl-N4-(phenylmethyl)pyrimidine-2,4-diamine IUPAC Name: 4-N-benzyl-2-N-[bis(aziridin-1-yl)phosphoryl]-4-N-methylpyrimidine-2,4-diamine Traditional Name: benzyl-[2-(diethyleniminophosphorylamino)pyrimidin-4-yl]-methyl-amine Formula: C16H21N6OP MolecularWeight: 344.351301

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C2=NC(=NC=C2)NP(=O)(N3CC3)N4CC4

Isomeric SMILES

CN(CC1=CC=CC=C1)C2=NC(=NC=C2)NP(=O)(N3CC3)N4CC4

InChI

InChI=1S/C16H21N6OP/c1-20(13-14-5-3-2-4-6-14)15-7-8-17-16(18-15)19-24(23,21-9-10-21)22-11-12-22/h2-8H,9-13H2,1H3,(H,17,18,19,23)