methyl 2-[(3-chloranyl-6-nitro-1-benzothiophen-2-yl)carbonylamino]-5-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[(3-chloranyl-6-nitro-1-benzothiophen-2-yl)carbonylamino]-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-[(3-chloro-6-nitro-benzothiophene-2-carbonyl)amino]-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[(3-chloro-6-nitro-1-benzothiophen-2-yl)-oxomethyl]amino]-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(3-chloro-6-nitro-1-benzothiophene-2-carbonyl)amino]-5-methylthiophene-3-carboxylate Traditional Name: 2-[(3-chloro-6-nitro-benzothiophene-2-carbonyl)amino]-5-methyl-thiophene-3-carboxylic acid methyl ester Formula: C16H11ClN2O5S2 MolecularWeight: 410.85194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)NC(=O)C2=C(C3=C(S2)C=C(C=C3)[N+](=O)[O-])Cl)C(=O)OC

Isomeric SMILES

CC1=CC(=C(S1)NC(=O)C2=C(C3=C(S2)C=C(C=C3)[N+](=O)[O-])Cl)C(=O)OC

InChI

InChI=1S/C16H11ClN2O5S2/c1-7-5-10(16(21)24-2)15(25-7)18-14(20)13-12(17)9-4-3-8(19(22)23)6-11(9)26-13/h3-6H,1-2H3,(H,18,20)