(3Z)-N-[methylsulfonyl(pentyl)carbamoyl]-2-morpholin-4-yl-3-(phenylmethylidene)cyclohexene-1-carboxamide

Systemtic Name: (3Z)-N-[methylsulfonyl(pentyl)carbamoyl]-2-morpholin-4-yl-3-(phenylmethylidene)cyclohexene-1-carboxamide Openeye Name: (3Z)-3-benzylidene-N-[methylsulfonyl(pentyl)carbamoyl]-2-morpholino-cyclohexene-1-carboxamide CAS Name: (3Z)-N-[[methylsulfonyl(pentyl)amino]-oxomethyl]-2-(4-morpholinyl)-3-(phenylmethylene)-1-cyclohexenecarboxamide IUPAC Name: (3Z)-3-benzylidene-N-[methylsulfonyl(pentyl)carbamoyl]-2-morpholin-4-ylcyclohexene-1-carboxamide Traditional Name: (3Z)-N-[amyl(mesyl)carbamoyl]-3-benzal-2-morpholino-cyclohexene-1-carboxamide Formula: C25H35N3O5S MolecularWeight: 489.6275

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(C(=O)NC(=O)C1=C(C(=CC2=CC=CC=C2)CCC1)N3CCOCC3)S(=O)(=O)C

Isomeric SMILES

CCCCCN(C(=O)NC(=O)C1=C(/C(=C\C2=CC=CC=C2)/CCC1)N3CCOCC3)S(=O)(=O)C

InChI

InChI=1S/C25H35N3O5S/c1-3-4-8-14-28(34(2,31)32)25(30)26-24(29)22-13-9-12-21(19-20-10-6-5-7-11-20)23(22)27-15-17-33-18-16-27/h5-7,10-11,19H,3-4,8-9,12-18H2,1-2H3,(H,26,29,30)/b21-19-