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

Systemtic Name: methyl-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]-[(4-phenyl-1,3-thiazol-2-yl)methyl]azanium Openeye Name: [2-(isopropylamino)-2-oxo-ethyl]-methyl-[(4-phenylthiazol-2-yl)methyl]ammonium CAS Name: methyl-[2-oxo-2-(propan-2-ylamino)ethyl]-[(4-phenyl-2-thiazolyl)methyl]ammonium IUPAC Name: methyl-[2-oxo-2-(propan-2-ylamino)ethyl]-[(4-phenyl-1,3-thiazol-2-yl)methyl]azanium Traditional Name: [2-(isopropylamino)-2-keto-ethyl]-methyl-[(4-phenylthiazol-2-yl)methyl]ammonium Formula: C16H22N3OS+ MolecularWeight: 304.43038

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21N3OS/c1-12(2)17-15(20)9-19(3)10-16-18-14(11-21-16)13-7-5-4-6-8-13/h4-8,11-12H,9-10H2,1-3H3,(H,17,20)/p+1