N-(pyrimidin-4-ylmethyl)-3a,4,5,6-tetrahydro-1H-perimidin-2-amine

Systemtic Name: N-(pyrimidin-4-ylmethyl)-3a,4,5,6-tetrahydro-1H-perimidin-2-amine Openeye Name: N-(pyrimidin-4-ylmethyl)-3a,4,5,6-tetrahydro-1H-perimidin-2-amine CAS Name: N-(4-pyrimidinylmethyl)-3a,4,5,6-tetrahydro-1H-perimidin-2-amine IUPAC Name: N-(pyrimidin-4-ylmethyl)-3a,4,5,6-tetrahydro-1H-perimidin-2-amine Traditional Name: 3a,4,5,6-tetrahydro-1H-perimidin-2-yl(4-pyrimidylmethyl)amine Formula: C16H17N5 MolecularWeight: 279.33968

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2C3=C(C1)C=CC=C3NC(=N2)NCC4=NC=NC=C4

Isomeric SMILES

C1CC2C3=C(C1)C=CC=C3NC(=N2)NCC4=NC=NC=C4

InChI

InChI=1S/C16H17N5/c1-3-11-4-2-6-14-15(11)13(5-1)20-16(21-14)18-9-12-7-8-17-10-19-12/h1,3,5,7-8,10,14H,2,4,6,9H2,(H2,18,20,21)