methyl 4-methyl-3-[2-[methyl-[(3-methylthiophen-2-yl)methyl]amino]ethanoylamino]benzoate

Systemtic Name: methyl 4-methyl-3-[2-[methyl-[(3-methylthiophen-2-yl)methyl]amino]ethanoylamino]benzoate Openeye Name: methyl 4-methyl-3-[[2-[methyl-[(3-methyl-2-thienyl)methyl]amino]acetyl]amino]benzoate CAS Name: 4-methyl-3-[[2-[methyl-[(3-methyl-2-thiophenyl)methyl]amino]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[[2-[methyl-[(3-methylthiophen-2-yl)methyl]amino]acetyl]amino]benzoate Traditional Name: 4-methyl-3-[[2-[methyl-[(3-methyl-2-thienyl)methyl]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)CC2=C(C=CS2)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CN(C)CC2=C(C=CS2)C

InChI

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