(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)methyl thiophene-2-carboxylate

Systemtic Name: (1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)methyl thiophene-2-carboxylate Openeye Name: [1-ethyl-5-(1-piperidylsulfonyl)benzimidazol-2-yl]methyl thiophene-2-carboxylate CAS Name: 2-thiophenecarboxylic acid [1-ethyl-5-(1-piperidinylsulfonyl)-2-benzimidazolyl]methyl ester IUPAC Name: (1-ethyl-5-piperidin-1-ylsulfonylbenzimidazol-2-yl)methyl thiophene-2-carboxylate Traditional Name: thiophene-2-carboxylic acid (1-ethyl-5-piperidinosulfonyl-benzimidazol-2-yl)methyl ester Formula: C20H23N3O4S2 MolecularWeight: 433.54432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1COC(=O)C4=CC=CS4

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1COC(=O)C4=CC=CS4

InChI

InChI=1S/C20H23N3O4S2/c1-2-23-17-9-8-15(29(25,26)22-10-4-3-5-11-22)13-16(17)21-19(23)14-27-20(24)18-7-6-12-28-18/h6-9,12-13H,2-5,10-11,14H2,1H3