N-[1-(3-bromanyl-4-methoxy-phenyl)ethyl]-2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-benzamide

Systemtic Name: N-[1-(3-bromanyl-4-methoxy-phenyl)ethyl]-2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-benzamide Openeye Name: N-[1-(3-bromo-4-methoxy-phenyl)ethyl]-2-(2-oxo-2-pyrrolidin-1-yl-ethyl)sulfanyl-benzamide CAS Name: N-[1-(3-bromo-4-methoxyphenyl)ethyl]-2-[[2-oxo-2-(1-pyrrolidinyl)ethyl]thio]benzamide IUPAC Name: N-[1-(3-bromo-4-methoxyphenyl)ethyl]-2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanylbenzamide Traditional Name: N-[1-(3-bromo-4-methoxy-phenyl)ethyl]-2-[(2-keto-2-pyrrolidino-ethyl)thio]benzamide Formula: C22H25BrN2O3S MolecularWeight: 477.4145

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)OC)Br)NC(=O)C2=CC=CC=C2SCC(=O)N3CCCC3

Isomeric SMILES

CC(C1=CC(=C(C=C1)OC)Br)NC(=O)C2=CC=CC=C2SCC(=O)N3CCCC3

InChI

InChI=1S/C22H25BrN2O3S/c1-15(16-9-10-19(28-2)18(23)13-16)24-22(27)17-7-3-4-8-20(17)29-14-21(26)25-11-5-6-12-25/h3-4,7-10,13,15H,5-6,11-12,14H2,1-2H3,(H,24,27)