(5S)-N-cyclohexyl-5-(4-nitrophenyl)-4,5-dihydro-1,3-thiazol-3-ium-2-amine

Systemtic Name: (5S)-N-cyclohexyl-5-(4-nitrophenyl)-4,5-dihydro-1,3-thiazol-3-ium-2-amine Openeye Name: (5S)-N-cyclohexyl-5-(4-nitrophenyl)-4,5-dihydrothiazol-3-ium-2-amine CAS Name: (5S)-N-cyclohexyl-5-(4-nitrophenyl)-4,5-dihydrothiazol-3-ium-2-amine IUPAC Name: (5S)-N-cyclohexyl-5-(4-nitrophenyl)-4,5-dihydro-1,3-thiazol-3-ium-2-amine Traditional Name: cyclohexyl-[(5S)-5-(4-nitrophenyl)-2-thiazolin-3-ium-2-yl]amine Formula: C15H20N3O2S+ MolecularWeight: 306.4032

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC2=[NH+]CC(S2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)NC2=[NH+]C[C@@H](S2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H19N3O2S/c19-18(20)13-8-6-11(7-9-13)14-10-16-15(21-14)17-12-4-2-1-3-5-12/h6-9,12,14H,1-5,10H2,(H,16,17)/p+1/t14-/m1/s1