5-[3-azanyl-4-(4-methylpiperazin-1-yl)phenyl]-6-ethyl-pyrimidine-2,4-diamine

Systemtic Name: 5-[3-azanyl-4-(4-methylpiperazin-1-yl)phenyl]-6-ethyl-pyrimidine-2,4-diamine Openeye Name: 5-[3-amino-4-(4-methylpiperazin-1-yl)phenyl]-6-ethyl-pyrimidine-2,4-diamine CAS Name: 5-[3-amino-4-(4-methyl-1-piperazinyl)phenyl]-6-ethylpyrimidine-2,4-diamine IUPAC Name: 5-[3-amino-4-(4-methylpiperazin-1-yl)phenyl]-6-ethylpyrimidine-2,4-diamine Traditional Name: [2-amino-5-[3-amino-4-(4-methylpiperazino)phenyl]-6-ethyl-pyrimidin-4-yl]amine Formula: C17H25N7 MolecularWeight: 327.4273

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)N)N)C2=CC(=C(C=C2)N3CCN(CC3)C)N

Isomeric SMILES

CCC1=C(C(=NC(=N1)N)N)C2=CC(=C(C=C2)N3CCN(CC3)C)N

InChI

InChI=1S/C17H25N7/c1-3-13-15(16(19)22-17(20)21-13)11-4-5-14(12(18)10-11)24-8-6-23(2)7-9-24/h4-5,10H,3,6-9,18H2,1-2H3,(H4,19,20,21,22)