N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)-3-pyrrol-1-yl-thiophene-2-carboxamide

Systemtic Name: N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)-3-pyrrol-1-yl-thiophene-2-carboxamide Openeye Name: N-(4-methyl-3-morpholinosulfonyl-phenyl)-3-pyrrol-1-yl-thiophene-2-carboxamide CAS Name: N-[4-methyl-3-(4-morpholinylsulfonyl)phenyl]-3-(1-pyrrolyl)-2-thiophenecarboxamide IUPAC Name: N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)-3-pyrrol-1-ylthiophene-2-carboxamide Traditional Name: N-(4-methyl-3-morpholinosulfonyl-phenyl)-3-pyrrol-1-yl-thiophene-2-carboxamide Formula: C20H21N3O4S2 MolecularWeight: 431.52844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=C(C=CS2)N3C=CC=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=C(C=CS2)N3C=CC=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C20H21N3O4S2/c1-15-4-5-16(14-18(15)29(25,26)23-9-11-27-12-10-23)21-20(24)19-17(6-13-28-19)22-7-2-3-8-22/h2-8,13-14H,9-12H2,1H3,(H,21,24)