N-[4-(cyanomethyl)phenyl]-N-propan-2-ylsulfonyl-3-(2,3,4-trimethoxyphenyl)propanamide

Systemtic Name: N-[4-(cyanomethyl)phenyl]-N-propan-2-ylsulfonyl-3-(2,3,4-trimethoxyphenyl)propanamide Openeye Name: N-[4-(cyanomethyl)phenyl]-N-isopropylsulfonyl-3-(2,3,4-trimethoxyphenyl)propanamide CAS Name: N-[4-(cyanomethyl)phenyl]-N-propan-2-ylsulfonyl-3-(2,3,4-trimethoxyphenyl)propanamide IUPAC Name: N-[4-(cyanomethyl)phenyl]-N-propan-2-ylsulfonyl-3-(2,3,4-trimethoxyphenyl)propanamide Traditional Name: N-[4-(cyanomethyl)phenyl]-N-isopropylsulfonyl-3-(2,3,4-trimethoxyphenyl)propionamide Formula: C23H28N2O6S MolecularWeight: 460.54322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)N(C1=CC=C(C=C1)CC#N)C(=O)CCC2=C(C(=C(C=C2)OC)OC)OC

Isomeric SMILES

CC(C)S(=O)(=O)N(C1=CC=C(C=C1)CC#N)C(=O)CCC2=C(C(=C(C=C2)OC)OC)OC

InChI

InChI=1S/C23H28N2O6S/c1-16(2)32(27,28)25(19-10-6-17(7-11-19)14-15-24)21(26)13-9-18-8-12-20(29-3)23(31-5)22(18)30-4/h6-8,10-12,16H,9,13-14H2,1-5H3