cyclohexyl-[2-[[5-[(2,4-dimethylphenyl)carbamoyl]-3-ethoxycarbonyl-4-methyl-thiophen-2-yl]amino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: cyclohexyl-[2-[[5-[(2,4-dimethylphenyl)carbamoyl]-3-ethoxycarbonyl-4-methyl-thiophen-2-yl]amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: cyclohexyl-[2-[[5-[(2,4-dimethylphenyl)carbamoyl]-3-ethoxycarbonyl-4-methyl-2-thienyl]amino]-2-oxo-ethyl]-methyl-ammonium CAS Name: cyclohexyl-[2-[[5-[(2,4-dimethylanilino)-oxomethyl]-3-ethoxycarbonyl-4-methyl-2-thiophenyl]amino]-2-oxoethyl]-methylammonium IUPAC Name: cyclohexyl-[2-[[5-[(2,4-dimethylphenyl)carbamoyl]-3-ethoxycarbonyl-4-methylthiophen-2-yl]amino]-2-oxoethyl]-methylazanium Traditional Name: [2-[[3-carbethoxy-5-[(2,4-dimethylphenyl)carbamoyl]-4-methyl-2-thienyl]amino]-2-keto-ethyl]-cyclohexyl-methyl-ammonium Formula: C26H36N3O4S+ MolecularWeight: 486.64674

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=C(C=C(C=C2)C)C)NC(=O)C[NH+](C)C3CCCCC3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=C(C=C(C=C2)C)C)NC(=O)C[NH+](C)C3CCCCC3

InChI

InChI=1S/C26H35N3O4S/c1-6-33-26(32)22-18(4)23(24(31)27-20-13-12-16(2)14-17(20)3)34-25(22)28-21(30)15-29(5)19-10-8-7-9-11-19/h12-14,19H,6-11,15H2,1-5H3,(H,27,31)(H,28,30)/p+1