aminocarbonyl-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-cyclohexyl-[(4-methylphenyl)carbonylamino]azanium

Systemtic Name: aminocarbonyl-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-cyclohexyl-[(4-methylphenyl)carbonylamino]azanium Openeye Name: [4-(4-bromophenyl)thiazol-2-yl]-carbamoyl-cyclohexyl-[(4-methylbenzoyl)amino]ammonium CAS Name: [4-(4-bromophenyl)-2-thiazolyl]-carbamoyl-cyclohexyl-[[(4-methylphenyl)-oxomethyl]amino]ammonium IUPAC Name: [4-(4-bromophenyl)-1,3-thiazol-2-yl]-carbamoyl-cyclohexyl-[(4-methylbenzoyl)amino]azanium Traditional Name: [4-(4-bromophenyl)thiazol-2-yl]-carbamoyl-cyclohexyl-(p-toluoylamino)ammonium Formula: C24H26BrN4O2S+ MolecularWeight: 514.45784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N[N+](C2CCCCC2)(C3=NC(=CS3)C4=CC=C(C=C4)Br)C(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N[N+](C2CCCCC2)(C3=NC(=CS3)C4=CC=C(C=C4)Br)C(=O)N

InChI

InChI=1S/C24H25BrN4O2S/c1-16-7-9-18(10-8-16)22(30)28-29(23(26)31,20-5-3-2-4-6-20)24-27-21(15-32-24)17-11-13-19(25)14-12-17/h7-15,20H,2-6H2,1H3,(H2-,26,28,30,31)/p+1