N-[4-bromanyl-2-(phenylcarbonyl)phenyl]-4-(3,5-dimethylpiperidin-1-yl)sulfonyl-benzamide

Systemtic Name: N-[4-bromanyl-2-(phenylcarbonyl)phenyl]-4-(3,5-dimethylpiperidin-1-yl)sulfonyl-benzamide Openeye Name: N-(2-benzoyl-4-bromo-phenyl)-4-[(3,5-dimethyl-1-piperidyl)sulfonyl]benzamide CAS Name: N-(2-benzoyl-4-bromophenyl)-4-[(3,5-dimethyl-1-piperidinyl)sulfonyl]benzamide IUPAC Name: N-(2-benzoyl-4-bromophenyl)-4-(3,5-dimethylpiperidin-1-yl)sulfonylbenzamide Traditional Name: N-(2-benzoyl-4-bromo-phenyl)-4-(3,5-dimethylpiperidino)sulfonyl-benzamide Formula: C27H27BrN2O4S MolecularWeight: 555.48328

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=C(C=C(C=C3)Br)C(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=C(C=C(C=C3)Br)C(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C27H27BrN2O4S/c1-18-14-19(2)17-30(16-18)35(33,34)23-11-8-21(9-12-23)27(32)29-25-13-10-22(28)15-24(25)26(31)20-6-4-3-5-7-20/h3-13,15,18-19H,14,16-17H2,1-2H3,(H,29,32)