4,5-dimethyl-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]-2-pyrrol-1-yl-thiophene-3-carboxamide

Systemtic Name: 4,5-dimethyl-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]-2-pyrrol-1-yl-thiophene-3-carboxamide Openeye Name: 4,5-dimethyl-N-[(2-morpholinosulfonylphenyl)methyl]-2-pyrrol-1-yl-thiophene-3-carboxamide CAS Name: 4,5-dimethyl-N-[[2-(4-morpholinylsulfonyl)phenyl]methyl]-2-(1-pyrrolyl)-3-thiophenecarboxamide IUPAC Name: 4,5-dimethyl-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]-2-pyrrol-1-ylthiophene-3-carboxamide Traditional Name: 4,5-dimethyl-N-(2-morpholinosulfonylbenzyl)-2-pyrrol-1-yl-thiophene-3-carboxamide Formula: C22H25N3O4S2 MolecularWeight: 459.5816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)NCC2=CC=CC=C2S(=O)(=O)N3CCOCC3)N4C=CC=C4)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)NCC2=CC=CC=C2S(=O)(=O)N3CCOCC3)N4C=CC=C4)C

InChI

InChI=1S/C22H25N3O4S2/c1-16-17(2)30-22(24-9-5-6-10-24)20(16)21(26)23-15-18-7-3-4-8-19(18)31(27,28)25-11-13-29-14-12-25/h3-10H,11-15H2,1-2H3,(H,23,26)