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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)CNC(=O)C3=C(C=CS3)N4C=CC=C4

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)CNC(=O)C3=C(C=CS3)N4C=CC=C4

InChI

InChI=1S/C20H21N3O4S2/c24-20(19-18(7-14-28-19)22-8-1-2-9-22)21-15-16-3-5-17(6-4-16)29(25,26)23-10-12-27-13-11-23/h1-9,14H,10-13,15H2,(H,21,24)