[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]-propyl-[(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl]azanium

Systemtic Name: [2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]-propyl-[(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl]azanium Openeye Name: [2-(2-methylanilino)-2-oxo-ethyl]-propyl-[[2-(3-thienyl)thiazol-4-yl]methyl]ammonium CAS Name: [2-(2-methylanilino)-2-oxoethyl]-propyl-[[2-(3-thiophenyl)-4-thiazolyl]methyl]ammonium IUPAC Name: [2-(2-methylanilino)-2-oxoethyl]-propyl-[(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl]azanium Traditional Name: [2-keto-2-(o-toluidino)ethyl]-propyl-[[2-(3-thienyl)thiazol-4-yl]methyl]ammonium Formula: C20H24N3OS2+ MolecularWeight: 386.55406

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+](CC1=CSC(=N1)C2=CSC=C2)CC(=O)NC3=CC=CC=C3C

Isomeric SMILES

CCC[NH+](CC1=CSC(=N1)C2=CSC=C2)CC(=O)NC3=CC=CC=C3C

InChI

InChI=1S/C20H23N3OS2/c1-3-9-23(12-19(24)22-18-7-5-4-6-15(18)2)11-17-14-26-20(21-17)16-8-10-25-13-16/h4-8,10,13-14H,3,9,11-12H2,1-2H3,(H,22,24)/p+1