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

Systemtic Name: [2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl]-methyl-[(2-phenyl-1,3-thiazol-4-yl)methyl]azanium Openeye Name: [2-(2-ethylanilino)-2-oxo-ethyl]-methyl-[(2-phenylthiazol-4-yl)methyl]ammonium CAS Name: [2-(2-ethylanilino)-2-oxoethyl]-methyl-[(2-phenyl-4-thiazolyl)methyl]ammonium IUPAC Name: [2-(2-ethylanilino)-2-oxoethyl]-methyl-[(2-phenyl-1,3-thiazol-4-yl)methyl]azanium Traditional Name: [2-(2-ethylanilino)-2-keto-ethyl]-methyl-[(2-phenylthiazol-4-yl)methyl]ammonium Formula: C21H24N3OS+ MolecularWeight: 366.49976

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)C[NH+](C)CC2=CSC(=N2)C3=CC=CC=C3

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)C[NH+](C)CC2=CSC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C21H23N3OS/c1-3-16-9-7-8-12-19(16)23-20(25)14-24(2)13-18-15-26-21(22-18)17-10-5-4-6-11-17/h4-12,15H,3,13-14H2,1-2H3,(H,23,25)/p+1