2-[4-[(2-azanylpyrimidin-5-yl)methyl]-1-(thiophen-3-ylmethyl)piperazin-2-yl]ethanol

Systemtic Name: 2-[4-[(2-azanylpyrimidin-5-yl)methyl]-1-(thiophen-3-ylmethyl)piperazin-2-yl]ethanol Openeye Name: 2-[4-[(2-aminopyrimidin-5-yl)methyl]-1-(3-thienylmethyl)piperazin-2-yl]ethanol CAS Name: 2-[4-[(2-amino-5-pyrimidinyl)methyl]-1-(3-thiophenylmethyl)-2-piperazinyl]ethanol IUPAC Name: 2-[4-[(2-aminopyrimidin-5-yl)methyl]-1-(thiophen-3-ylmethyl)piperazin-2-yl]ethanol Traditional Name: 2-[4-[(2-aminopyrimidin-5-yl)methyl]-1-(3-thenyl)piperazin-2-yl]ethanol Formula: C16H23N5OS MolecularWeight: 333.45172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1CC2=CN=C(N=C2)N)CCO)CC3=CSC=C3

Isomeric SMILES

C1CN(C(CN1CC2=CN=C(N=C2)N)CCO)CC3=CSC=C3

InChI

InChI=1S/C16H23N5OS/c17-16-18-7-14(8-19-16)9-20-3-4-21(15(11-20)1-5-22)10-13-2-6-23-12-13/h2,6-8,12,15,22H,1,3-5,9-11H2,(H2,17,18,19)