methyl 4-(3-ethoxypropylcarbamothioylamino)benzoate

Systemtic Name: methyl 4-(3-ethoxypropylcarbamothioylamino)benzoate Openeye Name: methyl 4-(3-ethoxypropylcarbamothioylamino)benzoate CAS Name: 4-[[(3-ethoxypropylamino)-sulfanylidenemethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-(3-ethoxypropylcarbamothioylamino)benzoate Traditional Name: 4-(3-ethoxypropylthiocarbamoylamino)benzoic acid methyl ester Formula: C14H20N2O3S MolecularWeight: 296.3852

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=S)NC1=CC=C(C=C1)C(=O)OC

Isomeric SMILES

CCOCCCNC(=S)NC1=CC=C(C=C1)C(=O)OC

InChI

InChI=1S/C14H20N2O3S/c1-3-19-10-4-9-15-14(20)16-12-7-5-11(6-8-12)13(17)18-2/h5-8H,3-4,9-10H2,1-2H3,(H2,15,16,20)