N4-[2-(2-azanylpyrimidin-4-yl)-3-methyl-1-benzothiophen-5-yl]-N2-(2-diethylaminoethyl)pyrimidine-2,4-diamine

Systemtic Name: N4-[2-(2-azanylpyrimidin-4-yl)-3-methyl-1-benzothiophen-5-yl]-N2-(2-diethylaminoethyl)pyrimidine-2,4-diamine Openeye Name: N4-[2-(2-aminopyrimidin-4-yl)-3-methyl-benzothiophen-5-yl]-N2-(2-diethylaminoethyl)pyrimidine-2,4-diamine CAS Name: N4-[2-(2-amino-4-pyrimidinyl)-3-methyl-1-benzothiophen-5-yl]-N2-(2-diethylaminoethyl)pyrimidine-2,4-diamine IUPAC Name: 4-N-[2-(2-aminopyrimidin-4-yl)-3-methyl-1-benzothiophen-5-yl]-2-N-(2-diethylaminoethyl)pyrimidine-2,4-diamine Traditional Name: 2-[[4-[[2-(2-aminopyrimidin-4-yl)-3-methyl-benzothiophen-5-yl]amino]pyrimidin-2-yl]amino]ethyl-diethyl-amine Formula: C23H28N8S MolecularWeight: 448.58702

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC1=NC=CC(=N1)NC2=CC3=C(C=C2)SC(=C3C)C4=NC(=NC=C4)N

Isomeric SMILES

CCN(CC)CCNC1=NC=CC(=N1)NC2=CC3=C(C=C2)SC(=C3C)C4=NC(=NC=C4)N

InChI

InChI=1S/C23H28N8S/c1-4-31(5-2)13-12-27-23-26-11-9-20(30-23)28-16-6-7-19-17(14-16)15(3)21(32-19)18-8-10-25-22(24)29-18/h6-11,14H,4-5,12-13H2,1-3H3,(H2,24,25,29)(H2,26,27,28,30)