dimethyl 3-methyl-5-[2-(5-phenyl-1,2,3,4-tetrazol-2-yl)ethanoylamino]thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 3-methyl-5-[2-(5-phenyl-1,2,3,4-tetrazol-2-yl)ethanoylamino]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 3-methyl-5-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[1-oxo-2-(5-phenyl-2-tetrazolyl)ethyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-methyl-5-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C18H17N5O5S MolecularWeight: 415.42308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)CN2N=C(N=N2)C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)CN2N=C(N=N2)C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C18H17N5O5S/c1-10-13(17(25)27-2)16(29-14(10)18(26)28-3)19-12(24)9-23-21-15(20-22-23)11-7-5-4-6-8-11/h4-8H,9H2,1-3H3,(H,19,24)