N-(4-bromanyl-2-methyl-phenyl)-2-(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)ethanamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)ethanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-2-(5-pyrrolidin-1-ylsulfonyl-2-thienyl)acetamide CAS Name: N-(4-bromo-2-methylphenyl)-2-[5-(1-pyrrolidinylsulfonyl)-2-thiophenyl]acetamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2-(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)acetamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-2-(5-pyrrolidinosulfonyl-2-thienyl)acetamide Formula: C17H19BrN2O3S2 MolecularWeight: 443.37836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CC2=CC=C(S2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CC2=CC=C(S2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C17H19BrN2O3S2/c1-12-10-13(18)4-6-15(12)19-16(21)11-14-5-7-17(24-14)25(22,23)20-8-2-3-9-20/h4-7,10H,2-3,8-9,11H2,1H3,(H,19,21)