N,1-dimethyl-N-[(4-methylsulfanylphenyl)methyl]-4-morpholin-4-ylsulfonyl-pyrrole-2-carboxamide

Systemtic Name: N,1-dimethyl-N-[(4-methylsulfanylphenyl)methyl]-4-morpholin-4-ylsulfonyl-pyrrole-2-carboxamide Openeye Name: N,1-dimethyl-N-[(4-methylsulfanylphenyl)methyl]-4-morpholinosulfonyl-pyrrole-2-carboxamide CAS Name: N,1-dimethyl-N-[[4-(methylthio)phenyl]methyl]-4-(4-morpholinylsulfonyl)-2-pyrrolecarboxamide IUPAC Name: N,1-dimethyl-N-[(4-methylsulfanylphenyl)methyl]-4-morpholin-4-ylsulfonylpyrrole-2-carboxamide Traditional Name: N,1-dimethyl-N-[4-(methylthio)benzyl]-4-morpholinosulfonyl-pyrrole-2-carboxamide Formula: C19H25N3O4S2 MolecularWeight: 423.5495

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)N(C)CC2=CC=C(C=C2)SC)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CN1C=C(C=C1C(=O)N(C)CC2=CC=C(C=C2)SC)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C19H25N3O4S2/c1-20-14-17(28(24,25)22-8-10-26-11-9-22)12-18(20)19(23)21(2)13-15-4-6-16(27-3)7-5-15/h4-7,12,14H,8-11,13H2,1-3H3