[4-(4-acetamidophenyl)-1,3-thiazol-2-yl]methyl-methyl-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]azanium

Systemtic Name: [4-(4-acetamidophenyl)-1,3-thiazol-2-yl]methyl-methyl-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]azanium Openeye Name: [4-(4-acetamidophenyl)thiazol-2-yl]methyl-[2-(isopropylamino)-2-oxo-ethyl]-methyl-ammonium CAS Name: [4-(4-acetamidophenyl)-2-thiazolyl]methyl-methyl-[2-oxo-2-(propan-2-ylamino)ethyl]ammonium IUPAC Name: [4-(4-acetamidophenyl)-1,3-thiazol-2-yl]methyl-methyl-[2-oxo-2-(propan-2-ylamino)ethyl]azanium Traditional Name: [4-(4-acetamidophenyl)thiazol-2-yl]methyl-[2-(isopropylamino)-2-keto-ethyl]-methyl-ammonium Formula: C18H25N4O2S+ MolecularWeight: 361.4817

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C[NH+](C)CC1=NC(=CS1)C2=CC=C(C=C2)NC(=O)C

Isomeric SMILES

CC(C)NC(=O)C[NH+](C)CC1=NC(=CS1)C2=CC=C(C=C2)NC(=O)C

InChI

InChI=1S/C18H24N4O2S/c1-12(2)19-17(24)9-22(4)10-18-21-16(11-25-18)14-5-7-15(8-6-14)20-13(3)23/h5-8,11-12H,9-10H2,1-4H3,(H,19,24)(H,20,23)/p+1