4-bromanyl-3,5-dimethoxy-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]benzamide

Systemtic Name: 4-bromanyl-3,5-dimethoxy-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]benzamide Openeye Name: 4-bromo-3,5-dimethoxy-N-[(5-pyrrolidin-1-ylsulfonyl-2-thienyl)methyl]benzamide CAS Name: 4-bromo-3,5-dimethoxy-N-[[5-(1-pyrrolidinylsulfonyl)-2-thiophenyl]methyl]benzamide IUPAC Name: 4-bromo-3,5-dimethoxy-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]benzamide Traditional Name: 4-bromo-3,5-dimethoxy-N-[(5-pyrrolidinosulfonyl-2-thienyl)methyl]benzamide Formula: C18H21BrN2O5S2 MolecularWeight: 489.40374

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1Br)OC)C(=O)NCC2=CC=C(S2)S(=O)(=O)N3CCCC3

Isomeric SMILES

COC1=CC(=CC(=C1Br)OC)C(=O)NCC2=CC=C(S2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C18H21BrN2O5S2/c1-25-14-9-12(10-15(26-2)17(14)19)18(22)20-11-13-5-6-16(27-13)28(23,24)21-7-3-4-8-21/h5-6,9-10H,3-4,7-8,11H2,1-2H3,(H,20,22)