N4-(4-butylphenyl)-N6-(2-thiophen-2-ylethyl)pyrimidine-4,5,6-triamine

Systemtic Name: N4-(4-butylphenyl)-N6-(2-thiophen-2-ylethyl)pyrimidine-4,5,6-triamine Openeye Name: N4-(4-butylphenyl)-N6-[2-(2-thienyl)ethyl]pyrimidine-4,5,6-triamine CAS Name: N4-(4-butylphenyl)-N6-(2-thiophen-2-ylethyl)pyrimidine-4,5,6-triamine IUPAC Name: 4-N-(4-butylphenyl)-6-N-(2-thiophen-2-ylethyl)pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-(4-butylanilino)pyrimidin-4-yl]-[2-(2-thienyl)ethyl]amine Formula: C20H25N5S MolecularWeight: 367.511

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC2=C(C(=NC=N2)NCCC3=CC=CS3)N

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC2=C(C(=NC=N2)NCCC3=CC=CS3)N

InChI

InChI=1S/C20H25N5S/c1-2-3-5-15-7-9-16(10-8-15)25-20-18(21)19(23-14-24-20)22-12-11-17-6-4-13-26-17/h4,6-10,13-14H,2-3,5,11-12,21H2,1H3,(H2,22,23,24,25)