[2-[[3-ethoxycarbonyl-5-methyl-4-(4-methylphenyl)thiophen-2-yl]amino]-2-oxidanylidene-ethyl]-phenethyl-azanium

Systemtic Name: [2-[[3-ethoxycarbonyl-5-methyl-4-(4-methylphenyl)thiophen-2-yl]amino]-2-oxidanylidene-ethyl]-phenethyl-azanium Openeye Name: [2-[[3-ethoxycarbonyl-5-methyl-4-(p-tolyl)-2-thienyl]amino]-2-oxo-ethyl]-phenethyl-ammonium CAS Name: [2-[[3-ethoxycarbonyl-5-methyl-4-(4-methylphenyl)-2-thiophenyl]amino]-2-oxoethyl]-phenethylammonium IUPAC Name: [2-[[3-ethoxycarbonyl-5-methyl-4-(4-methylphenyl)thiophen-2-yl]amino]-2-oxoethyl]-phenethylazanium Traditional Name: [2-[[3-carbethoxy-5-methyl-4-(p-tolyl)-2-thienyl]amino]-2-keto-ethyl]-phenethyl-ammonium Formula: C25H29N2O3S+ MolecularWeight: 437.57436

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C2=CC=C(C=C2)C)C)NC(=O)C[NH2+]CCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C2=CC=C(C=C2)C)C)NC(=O)C[NH2+]CCC3=CC=CC=C3

InChI

InChI=1S/C25H28N2O3S/c1-4-30-25(29)23-22(20-12-10-17(2)11-13-20)18(3)31-24(23)27-21(28)16-26-15-14-19-8-6-5-7-9-19/h5-13,26H,4,14-16H2,1-3H3,(H,27,28)/p+1