2-(4-bromophenyl)sulfanyl-5-(3,5-dimethylpiperidin-1-yl)sulfonyl-N-(3-methoxypropyl)benzamide

Systemtic Name: 2-(4-bromophenyl)sulfanyl-5-(3,5-dimethylpiperidin-1-yl)sulfonyl-N-(3-methoxypropyl)benzamide Openeye Name: 2-(4-bromophenyl)sulfanyl-5-[(3,5-dimethyl-1-piperidyl)sulfonyl]-N-(3-methoxypropyl)benzamide CAS Name: 2-[(4-bromophenyl)thio]-5-[(3,5-dimethyl-1-piperidinyl)sulfonyl]-N-(3-methoxypropyl)benzamide IUPAC Name: 2-(4-bromophenyl)sulfanyl-5-(3,5-dimethylpiperidin-1-yl)sulfonyl-N-(3-methoxypropyl)benzamide Traditional Name: 2-[(4-bromophenyl)thio]-5-(3,5-dimethylpiperidino)sulfonyl-N-(3-methoxypropyl)benzamide Formula: C24H31BrN2O4S2 MolecularWeight: 555.54794

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC(=C(C=C2)SC3=CC=C(C=C3)Br)C(=O)NCCCOC)C

Isomeric SMILES

CC1CC(CN(C1)S(=O)(=O)C2=CC(=C(C=C2)SC3=CC=C(C=C3)Br)C(=O)NCCCOC)C

InChI

InChI=1S/C24H31BrN2O4S2/c1-17-13-18(2)16-27(15-17)33(29,30)21-9-10-23(32-20-7-5-19(25)6-8-20)22(14-21)24(28)26-11-4-12-31-3/h5-10,14,17-18H,4,11-13,15-16H2,1-3H3,(H,26,28)