[2-[(3-ethoxycarbonyl-4,5-dimethyl-thiophen-2-yl)amino]-2-oxidanylidene-ethyl]-bis(phenylmethyl)azanium

Systemtic Name: [2-[(3-ethoxycarbonyl-4,5-dimethyl-thiophen-2-yl)amino]-2-oxidanylidene-ethyl]-bis(phenylmethyl)azanium Openeye Name: dibenzyl-[2-[(3-ethoxycarbonyl-4,5-dimethyl-2-thienyl)amino]-2-oxo-ethyl]ammonium CAS Name: [2-[(3-ethoxycarbonyl-4,5-dimethyl-2-thiophenyl)amino]-2-oxoethyl]-bis(phenylmethyl)ammonium IUPAC Name: dibenzyl-[2-[(3-ethoxycarbonyl-4,5-dimethylthiophen-2-yl)amino]-2-oxoethyl]azanium Traditional Name: dibenzyl-[2-[(3-carbethoxy-4,5-dimethyl-2-thienyl)amino]-2-keto-ethyl]ammonium Formula: C25H29N2O3S+ MolecularWeight: 437.57436

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C[NH+](CC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C[NH+](CC2=CC=CC=C2)CC3=CC=CC=C3

InChI

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