2-[4-bromanyl-2-[[5-[(4-methoxyphenyl)methylsulfanyl]-2-oxidanylidene-pentyl]amino]phenyl]sulfanyl-N,N-dimethyl-benzamide

Systemtic Name: 2-[4-bromanyl-2-[[5-[(4-methoxyphenyl)methylsulfanyl]-2-oxidanylidene-pentyl]amino]phenyl]sulfanyl-N,N-dimethyl-benzamide Openeye Name: 2-[4-bromo-2-[[5-[(4-methoxyphenyl)methylsulfanyl]-2-oxo-pentyl]amino]phenyl]sulfanyl-N,N-dimethyl-benzamide CAS Name: 2-[[4-bromo-2-[[5-[(4-methoxyphenyl)methylthio]-2-oxopentyl]amino]phenyl]thio]-N,N-dimethylbenzamide IUPAC Name: 2-[4-bromo-2-[[5-[(4-methoxyphenyl)methylsulfanyl]-2-oxopentyl]amino]phenyl]sulfanyl-N,N-dimethylbenzamide Traditional Name: 2-[[4-bromo-2-[[2-keto-5-(p-anisylthio)pentyl]amino]phenyl]thio]-N,N-dimethyl-benzamide Formula: C28H31BrN2O3S2 MolecularWeight: 587.59134

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1=CC=CC=C1SC2=C(C=C(C=C2)Br)NCC(=O)CCCSCC3=CC=C(C=C3)OC

Isomeric SMILES

CN(C)C(=O)C1=CC=CC=C1SC2=C(C=C(C=C2)Br)NCC(=O)CCCSCC3=CC=C(C=C3)OC

InChI

InChI=1S/C28H31BrN2O3S2/c1-31(2)28(33)24-8-4-5-9-26(24)36-27-15-12-21(29)17-25(27)30-18-22(32)7-6-16-35-19-20-10-13-23(34-3)14-11-20/h4-5,8-15,17,30H,6-7,16,18-19H2,1-3H3