N4-(4-butylphenyl)-N6-prop-2-enyl-pyrimidine-4,5,6-triamine

Systemtic Name: N4-(4-butylphenyl)-N6-prop-2-enyl-pyrimidine-4,5,6-triamine Openeye Name: N6-allyl-N4-(4-butylphenyl)pyrimidine-4,5,6-triamine CAS Name: N4-(4-butylphenyl)-N6-prop-2-enylpyrimidine-4,5,6-triamine IUPAC Name: 4-N-(4-butylphenyl)-6-N-prop-2-enylpyrimidine-4,5,6-triamine Traditional Name: allyl-[5-amino-6-(4-butylanilino)pyrimidin-4-yl]amine Formula: C17H23N5 MolecularWeight: 297.39802

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC2=C(C(=NC=N2)NCC=C)N

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC2=C(C(=NC=N2)NCC=C)N

InChI

InChI=1S/C17H23N5/c1-3-5-6-13-7-9-14(10-8-13)22-17-15(18)16(19-11-4-2)20-12-21-17/h4,7-10,12H,2-3,5-6,11,18H2,1H3,(H2,19,20,21,22)