N-(1,3-benzodioxol-5-ylmethyl)-1-methyl-4-morpholin-4-ylsulfonyl-pyrrole-2-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-1-methyl-4-morpholin-4-ylsulfonyl-pyrrole-2-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-1-methyl-4-morpholinosulfonyl-pyrrole-2-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-1-methyl-4-(4-morpholinylsulfonyl)-2-pyrrolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-1-methyl-4-morpholin-4-ylsulfonylpyrrole-2-carboxamide Traditional Name: 1-methyl-4-morpholinosulfonyl-N-piperonyl-pyrrole-2-carboxamide Formula: C18H21N3O6S MolecularWeight: 407.44084

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)NCC2=CC3=C(C=C2)OCO3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CN1C=C(C=C1C(=O)NCC2=CC3=C(C=C2)OCO3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C18H21N3O6S/c1-20-11-14(28(23,24)21-4-6-25-7-5-21)9-15(20)18(22)19-10-13-2-3-16-17(8-13)27-12-26-16/h2-3,8-9,11H,4-7,10,12H2,1H3,(H,19,22)