N-[3-[1-[(2-bromophenyl)amino]-1-oxidanylidene-butan-2-yl]sulfanylphenyl]cyclohexanecarboxamide

Systemtic Name: N-[3-[1-[(2-bromophenyl)amino]-1-oxidanylidene-butan-2-yl]sulfanylphenyl]cyclohexanecarboxamide Openeye Name: N-[3-[1-[(2-bromophenyl)carbamoyl]propylsulfanyl]phenyl]cyclohexanecarboxamide CAS Name: N-[3-[[1-(2-bromoanilino)-1-oxobutan-2-yl]thio]phenyl]cyclohexanecarboxamide IUPAC Name: N-[3-[1-(2-bromoanilino)-1-oxobutan-2-yl]sulfanylphenyl]cyclohexanecarboxamide Traditional Name: N-[3-[1-[(2-bromophenyl)carbamoyl]propylthio]phenyl]cyclohexanecarboxamide Formula: C23H27BrN2O2S MolecularWeight: 475.44168

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC=C1Br)SC2=CC=CC(=C2)NC(=O)C3CCCCC3

Isomeric SMILES

CCC(C(=O)NC1=CC=CC=C1Br)SC2=CC=CC(=C2)NC(=O)C3CCCCC3

InChI

InChI=1S/C23H27BrN2O2S/c1-2-21(23(28)26-20-14-7-6-13-19(20)24)29-18-12-8-11-17(15-18)25-22(27)16-9-4-3-5-10-16/h6-8,11-16,21H,2-5,9-10H2,1H3,(H,25,27)(H,26,28)