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

Systemtic Name: [4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]methyl-methyl-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]azanium Openeye Name: [4-(4-ethoxyphenyl)thiazol-2-yl]methyl-[2-(isopropylamino)-2-oxo-ethyl]-methyl-ammonium CAS Name: [4-(4-ethoxyphenyl)-2-thiazolyl]methyl-methyl-[2-oxo-2-(propan-2-ylamino)ethyl]ammonium IUPAC Name: [4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]methyl-methyl-[2-oxo-2-(propan-2-ylamino)ethyl]azanium Traditional Name: [2-(isopropylamino)-2-keto-ethyl]-methyl-[(4-p-phenetylthiazol-2-yl)methyl]ammonium Formula: C18H26N3O2S+ MolecularWeight: 348.48294

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=CSC(=N2)C[NH+](C)CC(=O)NC(C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=CSC(=N2)C[NH+](C)CC(=O)NC(C)C

InChI

InChI=1S/C18H25N3O2S/c1-5-23-15-8-6-14(7-9-15)16-12-24-18(20-16)11-21(4)10-17(22)19-13(2)3/h6-9,12-13H,5,10-11H2,1-4H3,(H,19,22)/p+1