methyl 5-azanyl-4-(2-nitrophenyl)sulfanyl-thiophene-2-carboxylate

Systemtic Name: methyl 5-azanyl-4-(2-nitrophenyl)sulfanyl-thiophene-2-carboxylate Openeye Name: methyl 5-amino-4-(2-nitrophenyl)sulfanyl-thiophene-2-carboxylate CAS Name: 5-amino-4-[(2-nitrophenyl)thio]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-amino-4-(2-nitrophenyl)sulfanylthiophene-2-carboxylate Traditional Name: 5-amino-4-[(2-nitrophenyl)thio]thiophene-2-carboxylic acid methyl ester Formula: C12H10N2O4S2 MolecularWeight: 310.3488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(S1)N)SC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=C(S1)N)SC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C12H10N2O4S2/c1-18-12(15)10-6-9(11(13)20-10)19-8-5-3-2-4-7(8)14(16)17/h2-6H,13H2,1H3