(2-ethyl-1-benzofuran-3-yl)methyl-methyl-[(5-oxidanylidene-4-thiophen-2-yl-1,2,3,4-tetrazol-1-yl)methyl]azanium

Systemtic Name: (2-ethyl-1-benzofuran-3-yl)methyl-methyl-[(5-oxidanylidene-4-thiophen-2-yl-1,2,3,4-tetrazol-1-yl)methyl]azanium Openeye Name: (2-ethylbenzofuran-3-yl)methyl-methyl-[[5-oxo-4-(2-thienyl)tetrazol-1-yl]methyl]ammonium CAS Name: (2-ethyl-3-benzofuranyl)methyl-methyl-[(5-oxo-4-thiophen-2-yl-1-tetrazolyl)methyl]ammonium IUPAC Name: (2-ethyl-1-benzofuran-3-yl)methyl-methyl-[(5-oxo-4-thiophen-2-yltetrazol-1-yl)methyl]azanium Traditional Name: (2-ethylbenzofuran-3-yl)methyl-[[5-keto-4-(2-thienyl)tetrazol-1-yl]methyl]-methyl-ammonium Formula: C18H20N5O2S+ MolecularWeight: 370.4487

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=CC=CC=C2O1)C[NH+](C)CN3C(=O)N(N=N3)C4=CC=CS4

Isomeric SMILES

CCC1=C(C2=CC=CC=C2O1)C[NH+](C)CN3C(=O)N(N=N3)C4=CC=CS4

InChI

InChI=1S/C18H19N5O2S/c1-3-15-14(13-7-4-5-8-16(13)25-15)11-21(2)12-22-18(24)23(20-19-22)17-9-6-10-26-17/h4-10H,3,11-12H2,1-2H3/p+1