N-[[2,5-dimethyl-1-(3-morpholin-4-ylsulfonylphenyl)pyrrol-3-yl]methyl]-1-phenyl-methanamine; ethanedioic acid

Systemtic Name: N-[[2,5-dimethyl-1-(3-morpholin-4-ylsulfonylphenyl)pyrrol-3-yl]methyl]-1-phenyl-methanamine; ethanedioic acid Openeye Name: N-[[2,5-dimethyl-1-(3-morpholinosulfonylphenyl)pyrrol-3-yl]methyl]-1-phenyl-methanamine; oxalic acid CAS Name: N-[[2,5-dimethyl-1-[3-(4-morpholinylsulfonyl)phenyl]-3-pyrrolyl]methyl]-1-phenylmethanamine; oxalic acid IUPAC Name: N-[[2,5-dimethyl-1-(3-morpholin-4-ylsulfonylphenyl)pyrrol-3-yl]methyl]-1-phenylmethanamine; oxalic acid Traditional Name: benzyl-[[2,5-dimethyl-1-(3-morpholinosulfonylphenyl)pyrrol-3-yl]methyl]amine; oxalic acid Formula: C26H31N3O7S MolecularWeight: 529.60524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)C)CNCC4=CC=CC=C4.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC(=C(N1C2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)C)CNCC4=CC=CC=C4.C(=O)(C(=O)O)O

InChI

InChI=1S/C24H29N3O3S.C2H2O4/c1-19-15-22(18-25-17-21-7-4-3-5-8-21)20(2)27(19)23-9-6-10-24(16-23)31(28,29)26-11-13-30-14-12-26;3-1(4)2(5)6/h3-10,15-16,25H,11-14,17-18H2,1-2H3;(H,3,4)(H,5,6)