methyl 3-[(5-nitro-1-benzothiophen-2-yl)carbonylamino]-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 3-[(5-nitro-1-benzothiophen-2-yl)carbonylamino]-1-benzothiophene-2-carboxylate Openeye Name: methyl 3-[(5-nitrobenzothiophene-2-carbonyl)amino]benzothiophene-2-carboxylate CAS Name: 3-[[(5-nitro-1-benzothiophen-2-yl)-oxomethyl]amino]-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 3-[(5-nitro-1-benzothiophene-2-carbonyl)amino]-1-benzothiophene-2-carboxylate Traditional Name: 3-[(5-nitrobenzothiophene-2-carbonyl)amino]benzothiophene-2-carboxylic acid methyl ester Formula: C19H12N2O5S2 MolecularWeight: 412.43898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=CC=CC=C2S1)NC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=C(C2=CC=CC=C2S1)NC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H12N2O5S2/c1-26-19(23)17-16(12-4-2-3-5-14(12)28-17)20-18(22)15-9-10-8-11(21(24)25)6-7-13(10)27-15/h2-9H,1H3,(H,20,22)