3,5-dimethyl-N-[4-[4-(phenylmethyl)piperidin-1-yl]sulfonylphenyl]-1-benzofuran-2-carboxamide

Systemtic Name: 3,5-dimethyl-N-[4-[4-(phenylmethyl)piperidin-1-yl]sulfonylphenyl]-1-benzofuran-2-carboxamide Openeye Name: N-[4-[(4-benzyl-1-piperidyl)sulfonyl]phenyl]-3,5-dimethyl-benzofuran-2-carboxamide CAS Name: 3,5-dimethyl-N-[4-[[4-(phenylmethyl)-1-piperidinyl]sulfonyl]phenyl]-2-benzofurancarboxamide IUPAC Name: N-[4-(4-benzylpiperidin-1-yl)sulfonylphenyl]-3,5-dimethyl-1-benzofuran-2-carboxamide Traditional Name: N-[4-(4-benzylpiperidino)sulfonylphenyl]-3,5-dimethyl-coumarilamide Formula: C29H30N2O4S MolecularWeight: 502.6245

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(=C2C)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCC(CC4)CC5=CC=CC=C5

Isomeric SMILES

CC1=CC2=C(C=C1)OC(=C2C)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCC(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C29H30N2O4S/c1-20-8-13-27-26(18-20)21(2)28(35-27)29(32)30-24-9-11-25(12-10-24)36(33,34)31-16-14-23(15-17-31)19-22-6-4-3-5-7-22/h3-13,18,23H,14-17,19H2,1-2H3,(H,30,32)