methyl 4-[(4-ethoxyphenyl)carbamothioylamino]butanoate

Systemtic Name: methyl 4-[(4-ethoxyphenyl)carbamothioylamino]butanoate Openeye Name: methyl 4-[(4-ethoxyphenyl)carbamothioylamino]butanoate CAS Name: 4-[[(4-ethoxyanilino)-sulfanylidenemethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[(4-ethoxyphenyl)carbamothioylamino]butanoate Traditional Name: 4-(p-phenetylthiocarbamoylamino)butyric acid methyl ester Formula: C14H20N2O3S MolecularWeight: 296.3852

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)NCCCC(=O)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)NCCCC(=O)OC

InChI

InChI=1S/C14H20N2O3S/c1-3-19-12-8-6-11(7-9-12)16-14(20)15-10-4-5-13(17)18-2/h6-9H,3-5,10H2,1-2H3,(H2,15,16,20)