N-(2-morpholin-4-ylethyl)-N-[[2-(phenylmethyl)sulfonyl-3-prop-2-enyl-imidazol-4-yl]methyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-(2-morpholin-4-ylethyl)-N-[[2-(phenylmethyl)sulfonyl-3-prop-2-enyl-imidazol-4-yl]methyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[(3-allyl-2-benzylsulfonyl-imidazol-4-yl)methyl]-N-(2-morpholinoethyl)-1,3-benzodioxole-5-carboxamide CAS Name: N-[2-(4-morpholinyl)ethyl]-N-[[2-(phenylmethyl)sulfonyl-3-prop-2-enyl-4-imidazolyl]methyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[(2-benzylsulfonyl-3-prop-2-enylimidazol-4-yl)methyl]-N-(2-morpholin-4-ylethyl)-1,3-benzodioxole-5-carboxamide Traditional Name: N-[(3-allyl-2-benzylsulfonyl-imidazol-4-yl)methyl]-N-(2-morpholinoethyl)-piperonylamide Formula: C28H32N4O6S MolecularWeight: 552.64188

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=CN=C1S(=O)(=O)CC2=CC=CC=C2)CN(CCN3CCOCC3)C(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

C=CCN1C(=CN=C1S(=O)(=O)CC2=CC=CC=C2)CN(CCN3CCOCC3)C(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C28H32N4O6S/c1-2-10-32-24(18-29-28(32)39(34,35)20-22-6-4-3-5-7-22)19-31(12-11-30-13-15-36-16-14-30)27(33)23-8-9-25-26(17-23)38-21-37-25/h2-9,17-18H,1,10-16,19-21H2