N-[1-(4-bromophenyl)ethyl]-1-methyl-4-morpholin-4-ylsulfonyl-pyrrole-2-carboxamide

Systemtic Name: N-[1-(4-bromophenyl)ethyl]-1-methyl-4-morpholin-4-ylsulfonyl-pyrrole-2-carboxamide Openeye Name: N-[1-(4-bromophenyl)ethyl]-1-methyl-4-morpholinosulfonyl-pyrrole-2-carboxamide CAS Name: N-[1-(4-bromophenyl)ethyl]-1-methyl-4-(4-morpholinylsulfonyl)-2-pyrrolecarboxamide IUPAC Name: N-[1-(4-bromophenyl)ethyl]-1-methyl-4-morpholin-4-ylsulfonylpyrrole-2-carboxamide Traditional Name: N-[1-(4-bromophenyl)ethyl]-1-methyl-4-morpholinosulfonyl-pyrrole-2-carboxamide Formula: C18H22BrN3O4S MolecularWeight: 456.35398

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)Br)NC(=O)C2=CC(=CN2C)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC(C1=CC=C(C=C1)Br)NC(=O)C2=CC(=CN2C)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C18H22BrN3O4S/c1-13(14-3-5-15(19)6-4-14)20-18(23)17-11-16(12-21(17)2)27(24,25)22-7-9-26-10-8-22/h3-6,11-13H,7-10H2,1-2H3,(H,20,23)