5-(azepan-1-yl)-N-[(E)-1-pyridin-2-ylethylideneamino]-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-(azepan-1-yl)-N-[(E)-1-pyridin-2-ylethylideneamino]-1,3,4-thiadiazol-2-amine Openeye Name: 5-(azepan-1-yl)-N-[(E)-1-(2-pyridyl)ethylideneamino]-1,3,4-thiadiazol-2-amine CAS Name: 5-(1-azepanyl)-N-[(E)-1-(2-pyridinyl)ethylideneamino]-1,3,4-thiadiazol-2-amine IUPAC Name: 5-(azepan-1-yl)-N-[(E)-1-pyridin-2-ylethylideneamino]-1,3,4-thiadiazol-2-amine Traditional Name: [5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-[(E)-1-(2-pyridyl)ethylideneamino]amine Formula: C15H20N6S MolecularWeight: 316.4245

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC1=NN=C(S1)N2CCCCCC2)C3=CC=CC=N3

Isomeric SMILES

C/C(=N\NC1=NN=C(S1)N2CCCCCC2)/C3=CC=CC=N3

InChI

InChI=1S/C15H20N6S/c1-12(13-8-4-5-9-16-13)17-18-14-19-20-15(22-14)21-10-6-2-3-7-11-21/h4-5,8-9H,2-3,6-7,10-11H2,1H3,(H,18,19)/b17-12+