carbamothioyl-methyl-[(E)-1-pyrazin-2-ylethylideneamino]-(2-pyridin-2-ylethyl)azanium

Systemtic Name: carbamothioyl-methyl-[(E)-1-pyrazin-2-ylethylideneamino]-(2-pyridin-2-ylethyl)azanium Openeye Name: carbamothioyl-methyl-[(E)-1-pyrazin-2-ylethylideneamino]-[2-(2-pyridyl)ethyl]ammonium CAS Name: carbamothioyl-methyl-[(E)-1-(2-pyrazinyl)ethylideneamino]-[2-(2-pyridinyl)ethyl]ammonium IUPAC Name: carbamothioyl-methyl-[(E)-1-pyrazin-2-ylethylideneamino]-(2-pyridin-2-ylethyl)azanium Traditional Name: methyl-[(E)-1-pyrazin-2-ylethylideneamino]-[2-(2-pyridyl)ethyl]-thiocarbamoyl-ammonium Formula: C15H19N6S+ MolecularWeight: 315.41656

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N[N+](C)(CCC1=CC=CC=N1)C(=S)N)C2=NC=CN=C2

Isomeric SMILES

C/C(=N\[N+](C)(CCC1=CC=CC=N1)C(=S)N)/C2=NC=CN=C2

InChI

InChI=1S/C15H18N6S/c1-12(14-11-17-8-9-19-14)20-21(2,15(16)22)10-6-13-5-3-4-7-18-13/h3-5,7-9,11H,6,10H2,1-2H3,(H-,16,22)/p+1/b20-12+