(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)methyl naphthalene-1-carboxylate

Systemtic Name: (1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)methyl naphthalene-1-carboxylate Openeye Name: (1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)methyl naphthalene-1-carboxylate CAS Name: 1-naphthalenecarboxylic acid [1-ethyl-5-(4-morpholinylsulfonyl)-2-benzimidazolyl]methyl ester IUPAC Name: (1-ethyl-5-morpholin-4-ylsulfonylbenzimidazol-2-yl)methyl naphthalene-1-carboxylate Traditional Name: naphthalene-1-carboxylic acid (1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)methyl ester Formula: C25H25N3O5S MolecularWeight: 479.5481

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1COC(=O)C4=CC=CC5=CC=CC=C54

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1COC(=O)C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C25H25N3O5S/c1-2-28-23-11-10-19(34(30,31)27-12-14-32-15-13-27)16-22(23)26-24(28)17-33-25(29)21-9-5-7-18-6-3-4-8-20(18)21/h3-11,16H,2,12-15,17H2,1H3