N-(2-aminocarbonyl-4-chloranyl-6-methoxy-phenyl)-3-chloranyl-4-[(2-methylsulfonylpiperazin-1-yl)methyl]thiophene-2-carboxamide

Systemtic Name: N-(2-aminocarbonyl-4-chloranyl-6-methoxy-phenyl)-3-chloranyl-4-[(2-methylsulfonylpiperazin-1-yl)methyl]thiophene-2-carboxamide Openeye Name: N-(2-carbamoyl-4-chloro-6-methoxy-phenyl)-3-chloro-4-[(2-methylsulfonylpiperazin-1-yl)methyl]thiophene-2-carboxamide CAS Name: N-(2-carbamoyl-4-chloro-6-methoxyphenyl)-3-chloro-4-[(2-methylsulfonyl-1-piperazinyl)methyl]-2-thiophenecarboxamide IUPAC Name: N-(2-carbamoyl-4-chloro-6-methoxyphenyl)-3-chloro-4-[(2-methylsulfonylpiperazin-1-yl)methyl]thiophene-2-carboxamide Traditional Name: N-(2-carbamoyl-4-chloro-6-methoxy-phenyl)-3-chloro-4-[(2-mesylpiperazino)methyl]thiophene-2-carboxamide Formula: C19H22Cl2N4O5S2 MolecularWeight: 521.43778

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)Cl)C(=O)N)NC(=O)C2=C(C(=CS2)CN3CCNCC3S(=O)(=O)C)Cl

Isomeric SMILES

COC1=C(C(=CC(=C1)Cl)C(=O)N)NC(=O)C2=C(C(=CS2)CN3CCNCC3S(=O)(=O)C)Cl

InChI

InChI=1S/C19H22Cl2N4O5S2/c1-30-13-6-11(20)5-12(18(22)26)16(13)24-19(27)17-15(21)10(9-31-17)8-25-4-3-23-7-14(25)32(2,28)29/h5-6,9,14,23H,3-4,7-8H2,1-2H3,(H2,22,26)(H,24,27)