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

Systemtic Name: N-[methylsulfonyl(propan-2-yl)carbamoyl]-2-morpholin-4-yl-3-(phenylmethylidene)cyclohexene-1-carboxamide Openeye Name: 3-benzylidene-N-[isopropyl(methylsulfonyl)carbamoyl]-2-morpholino-cyclohexene-1-carboxamide CAS Name: N-[[methylsulfonyl(propan-2-yl)amino]-oxomethyl]-2-(4-morpholinyl)-3-(phenylmethylene)-1-cyclohexenecarboxamide IUPAC Name: 3-benzylidene-N-[methylsulfonyl(propan-2-yl)carbamoyl]-2-morpholin-4-ylcyclohexene-1-carboxamide Traditional Name: 3-benzal-N-[isopropyl(mesyl)carbamoyl]-2-morpholino-cyclohexene-1-carboxamide Formula: C23H31N3O5S MolecularWeight: 461.57434

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H31N3O5S/c1-17(2)26(32(3,29)30)23(28)24-22(27)20-11-7-10-19(16-18-8-5-4-6-9-18)21(20)25-12-14-31-15-13-25/h4-6,8-9,16-17H,7,10-15H2,1-3H3,(H,24,27,28)