methyl 5-oxidanylidene-1-(thiophen-2-ylmethyl)-2H-1,2,3-triazole-4-carboxylate; thiophen-2-ylmethanamine

Systemtic Name: methyl 5-oxidanylidene-1-(thiophen-2-ylmethyl)-2H-1,2,3-triazole-4-carboxylate; thiophen-2-ylmethanamine Openeye Name: methyl 5-oxo-1-(2-thienylmethyl)-2H-triazole-4-carboxylate; 2-thienylmethanamine CAS Name: 5-oxo-1-(thiophen-2-ylmethyl)-2H-triazole-4-carboxylic acid methyl ester; thiophen-2-ylmethanamine IUPAC Name: methyl 5-oxo-1-(thiophen-2-ylmethyl)-2H-triazole-4-carboxylate; thiophen-2-ylmethanamine Traditional Name: 5-keto-1-(2-thenyl)-2H-triazole-4-carboxylic acid methyl ester; 2-thenylamine Formula: C14H16N4O3S2 MolecularWeight: 352.43184

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NNN(C1=O)CC2=CC=CS2.C1=CSC(=C1)CN

Isomeric SMILES

COC(=O)C1=NNN(C1=O)CC2=CC=CS2.C1=CSC(=C1)CN

InChI

InChI=1S/C9H9N3O3S.C5H7NS/c1-15-9(14)7-8(13)12(11-10-7)5-6-3-2-4-16-6;6-4-5-2-1-3-7-5/h2-4,11H,5H2,1H3;1-3H,4,6H2