methyl 4-methyl-3-[2-[methyl(1-thiophen-2-ylethyl)amino]ethanoylamino]benzoate

Systemtic Name: methyl 4-methyl-3-[2-[methyl(1-thiophen-2-ylethyl)amino]ethanoylamino]benzoate Openeye Name: methyl 4-methyl-3-[[2-[methyl-[1-(2-thienyl)ethyl]amino]acetyl]amino]benzoate CAS Name: 4-methyl-3-[[2-[methyl(1-thiophen-2-ylethyl)amino]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[[2-[methyl(1-thiophen-2-ylethyl)amino]acetyl]amino]benzoate Traditional Name: 4-methyl-3-[[2-[methyl-[1-(2-thienyl)ethyl]amino]acetyl]amino]benzoic acid methyl ester Formula: C18H22N2O3S MolecularWeight: 346.44388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CN(C)C(C)C2=CC=CS2

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CN(C)C(C)C2=CC=CS2

InChI

InChI=1S/C18H22N2O3S/c1-12-7-8-14(18(22)23-4)10-15(12)19-17(21)11-20(3)13(2)16-6-5-9-24-16/h5-10,13H,11H2,1-4H3,(H,19,21)