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

Systemtic Name: N3-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1-quinolin-2-yl-1,2,4-triazole-3,5-diamine Openeye Name: N3-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1-(2-quinolyl)-1,2,4-triazole-3,5-diamine CAS Name: N3-[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]-1-(2-quinolinyl)-1,2,4-triazole-3,5-diamine IUPAC Name: 3-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1-quinolin-2-yl-1,2,4-triazole-3,5-diamine Traditional Name: [5-amino-1-(2-quinolyl)-1,2,4-triazol-3-yl]-[4-(2-pyrrolidinoethoxy)phenyl]amine Formula: C23H25N7O MolecularWeight: 415.4909

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCOC2=CC=C(C=C2)NC3=NN(C(=N3)N)C4=NC5=CC=CC=C5C=C4

Isomeric SMILES

C1CCN(C1)CCOC2=CC=C(C=C2)NC3=NN(C(=N3)N)C4=NC5=CC=CC=C5C=C4

InChI

InChI=1S/C23H25N7O/c24-22-27-23(28-30(22)21-12-7-17-5-1-2-6-20(17)26-21)25-18-8-10-19(11-9-18)31-16-15-29-13-3-4-14-29/h1-2,5-12H,3-4,13-16H2,(H3,24,25,27,28)