N6-(4-butylphenyl)-N4-(1,3-thiazol-2-yl)pyrimidine-4,5,6-triamine

Systemtic Name: N6-(4-butylphenyl)-N4-(1,3-thiazol-2-yl)pyrimidine-4,5,6-triamine Openeye Name: N6-(4-butylphenyl)-N4-thiazol-2-yl-pyrimidine-4,5,6-triamine CAS Name: N6-(4-butylphenyl)-N4-(2-thiazolyl)pyrimidine-4,5,6-triamine IUPAC Name: 6-N-(4-butylphenyl)-4-N-(1,3-thiazol-2-yl)pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-(4-butylanilino)pyrimidin-4-yl]-thiazol-2-yl-amine Formula: C17H20N6S MolecularWeight: 340.4459

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC2=C(C(=NC=N2)NC3=NC=CS3)N

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC2=C(C(=NC=N2)NC3=NC=CS3)N

InChI

InChI=1S/C17H20N6S/c1-2-3-4-12-5-7-13(8-6-12)22-15-14(18)16(21-11-20-15)23-17-19-9-10-24-17/h5-11H,2-4,18H2,1H3,(H2,19,20,21,22,23)