[4-(1H-1,2,4-triazol-5-ylsulfanyl)quinolin-3-yl]methanamine

Systemtic Name: [4-(1H-1,2,4-triazol-5-ylsulfanyl)quinolin-3-yl]methanamine Openeye Name: [4-(1H-1,2,4-triazol-5-ylsulfanyl)-3-quinolyl]methanamine CAS Name: [4-(1H-1,2,4-triazol-5-ylthio)-3-quinolinyl]methanamine IUPAC Name: [4-(1H-1,2,4-triazol-5-ylsulfanyl)quinolin-3-yl]methanamine Traditional Name: [4-(1H-1,2,4-triazol-5-ylthio)-3-quinolyl]methylamine Formula: C12H11N5S MolecularWeight: 257.31424

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(C=N2)CN)SC3=NC=NN3

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(C=N2)CN)SC3=NC=NN3

InChI

InChI=1S/C12H11N5S/c13-5-8-6-14-10-4-2-1-3-9(10)11(8)18-12-15-7-16-17-12/h1-4,6-7H,5,13H2,(H,15,16,17)