ethyl 5-ethyl-4-methyl-2-[2-(5-thiophen-3-yl-1,2,3,4-tetrazol-2-yl)ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 5-ethyl-4-methyl-2-[2-(5-thiophen-3-yl-1,2,3,4-tetrazol-2-yl)ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-ethyl-4-methyl-2-[[2-[5-(3-thienyl)tetrazol-2-yl]acetyl]amino]thiophene-3-carboxylate CAS Name: 5-ethyl-4-methyl-2-[[1-oxo-2-[5-(3-thiophenyl)-2-tetrazolyl]ethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-ethyl-4-methyl-2-[[2-(5-thiophen-3-yltetrazol-2-yl)acetyl]amino]thiophene-3-carboxylate Traditional Name: 5-ethyl-4-methyl-2-[[2-[5-(3-thienyl)tetrazol-2-yl]acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C17H19N5O3S2 MolecularWeight: 405.49446

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(S1)NC(=O)CN2N=C(N=N2)C3=CSC=C3)C(=O)OCC)C

Isomeric SMILES

CCC1=C(C(=C(S1)NC(=O)CN2N=C(N=N2)C3=CSC=C3)C(=O)OCC)C

InChI

InChI=1S/C17H19N5O3S2/c1-4-12-10(3)14(17(24)25-5-2)16(27-12)18-13(23)8-22-20-15(19-21-22)11-6-7-26-9-11/h6-7,9H,4-5,8H2,1-3H3,(H,18,23)