1-pyrazin-2-yl-N3-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1,2,4-triazole-3,5-diamine

Systemtic Name: 1-pyrazin-2-yl-N3-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1,2,4-triazole-3,5-diamine Openeye Name: 1-pyrazin-2-yl-N3-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1,2,4-triazole-3,5-diamine CAS Name: 1-(2-pyrazinyl)-N3-[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]-1,2,4-triazole-3,5-diamine IUPAC Name: 1-pyrazin-2-yl-3-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1,2,4-triazole-3,5-diamine Traditional Name: (5-amino-1-pyrazin-2-yl-1,2,4-triazol-3-yl)-[4-(2-pyrrolidinoethoxy)phenyl]amine Formula: C18H22N8O MolecularWeight: 366.42028

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCOC2=CC=C(C=C2)NC3=NN(C(=N3)N)C4=NC=CN=C4

Isomeric SMILES

C1CCN(C1)CCOC2=CC=C(C=C2)NC3=NN(C(=N3)N)C4=NC=CN=C4

InChI

InChI=1S/C18H22N8O/c19-17-23-18(24-26(17)16-13-20-7-8-21-16)22-14-3-5-15(6-4-14)27-12-11-25-9-1-2-10-25/h3-8,13H,1-2,9-12H2,(H3,19,22,23,24)