(4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-propan-2-yl-azanium

Systemtic Name: (4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-propan-2-yl-azanium Openeye Name: isopropyl-[(4-methyl-5-thioxo-1,2,4-triazol-1-yl)methyl]-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]ammonium CAS Name: (4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-propan-2-ylammonium IUPAC Name: (4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-propan-2-ylazanium Traditional Name: isopropyl-[(4-methyl-5-thioxo-1,2,4-triazol-1-yl)methyl]-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]ammonium Formula: C16H21N6OS+ MolecularWeight: 345.44254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](CC1=NN=C(O1)C2=CC=CC=C2)CN3C(=S)N(C=N3)C

Isomeric SMILES

CC(C)[NH+](CC1=NN=C(O1)C2=CC=CC=C2)CN3C(=S)N(C=N3)C

InChI

InChI=1S/C16H20N6OS/c1-12(2)21(11-22-16(24)20(3)10-17-22)9-14-18-19-15(23-14)13-7-5-4-6-8-13/h4-8,10,12H,9,11H2,1-3H3/p+1