methyl 4-[[3-methoxypropylcarbamothioyl(methyl)amino]carbamoyl]benzoate

Systemtic Name: methyl 4-[[3-methoxypropylcarbamothioyl(methyl)amino]carbamoyl]benzoate Openeye Name: methyl 4-[[3-methoxypropylcarbamothioyl(methyl)amino]carbamoyl]benzoate CAS Name: 4-[[2-[(3-methoxypropylamino)-sulfanylidenemethyl]-2-methylhydrazinyl]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[3-methoxypropylcarbamothioyl(methyl)amino]carbamoyl]benzoate Traditional Name: 4-[[3-methoxypropylthiocarbamoyl(methyl)amino]carbamoyl]benzoic acid methyl ester Formula: C15H21N3O4S MolecularWeight: 339.40994

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=S)NCCCOC)NC(=O)C1=CC=C(C=C1)C(=O)OC

Isomeric SMILES

CN(C(=S)NCCCOC)NC(=O)C1=CC=C(C=C1)C(=O)OC

InChI

InChI=1S/C15H21N3O4S/c1-18(15(23)16-9-4-10-21-2)17-13(19)11-5-7-12(8-6-11)14(20)22-3/h5-8H,4,9-10H2,1-3H3,(H,16,23)(H,17,19)