5-[(4-methylphenyl)methyl-methylsulfonyl-amino]-N-(3-propan-2-yloxypropyl)-1-benzothiophene-2-carboxamide

Systemtic Name: 5-[(4-methylphenyl)methyl-methylsulfonyl-amino]-N-(3-propan-2-yloxypropyl)-1-benzothiophene-2-carboxamide Openeye Name: N-(3-isopropoxypropyl)-5-[methylsulfonyl(p-tolylmethyl)amino]benzothiophene-2-carboxamide CAS Name: 5-[(4-methylphenyl)methyl-methylsulfonylamino]-N-(3-propan-2-yloxypropyl)-1-benzothiophene-2-carboxamide IUPAC Name: 5-[(4-methylphenyl)methyl-methylsulfonylamino]-N-(3-propan-2-yloxypropyl)-1-benzothiophene-2-carboxamide Traditional Name: N-(3-isopropoxypropyl)-5-[mesyl-(4-methylbenzyl)amino]benzothiophene-2-carboxamide Formula: C24H30N2O4S2 MolecularWeight: 474.636

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(C2=CC3=C(C=C2)SC(=C3)C(=O)NCCCOC(C)C)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)CN(C2=CC3=C(C=C2)SC(=C3)C(=O)NCCCOC(C)C)S(=O)(=O)C

InChI

InChI=1S/C24H30N2O4S2/c1-17(2)30-13-5-12-25-24(27)23-15-20-14-21(10-11-22(20)31-23)26(32(4,28)29)16-19-8-6-18(3)7-9-19/h6-11,14-15,17H,5,12-13,16H2,1-4H3,(H,25,27)