N-[1-(3-bromanyl-4-methoxy-phenyl)ethyl]-4-[methyl(thiophen-2-ylsulfonyl)amino]butanamide

Systemtic Name: N-[1-(3-bromanyl-4-methoxy-phenyl)ethyl]-4-[methyl(thiophen-2-ylsulfonyl)amino]butanamide Openeye Name: N-[1-(3-bromo-4-methoxy-phenyl)ethyl]-4-[methyl(2-thienylsulfonyl)amino]butanamide CAS Name: N-[1-(3-bromo-4-methoxyphenyl)ethyl]-4-[methyl(thiophen-2-ylsulfonyl)amino]butanamide IUPAC Name: N-[1-(3-bromo-4-methoxyphenyl)ethyl]-4-[methyl(thiophen-2-ylsulfonyl)amino]butanamide Traditional Name: N-[1-(3-bromo-4-methoxy-phenyl)ethyl]-4-[methyl(2-thienylsulfonyl)amino]butyramide Formula: C18H23BrN2O4S2 MolecularWeight: 475.42022

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)OC)Br)NC(=O)CCCN(C)S(=O)(=O)C2=CC=CS2

Isomeric SMILES

CC(C1=CC(=C(C=C1)OC)Br)NC(=O)CCCN(C)S(=O)(=O)C2=CC=CS2

InChI

InChI=1S/C18H23BrN2O4S2/c1-13(14-8-9-16(25-3)15(19)12-14)20-17(22)6-4-10-21(2)27(23,24)18-7-5-11-26-18/h5,7-9,11-13H,4,6,10H2,1-3H3,(H,20,22)