methyl 2-[(2-methoxyphenyl)carbamothioylamino]-3-methyl-butanoate

Systemtic Name: methyl 2-[(2-methoxyphenyl)carbamothioylamino]-3-methyl-butanoate Openeye Name: methyl 2-[(2-methoxyphenyl)carbamothioylamino]-3-methyl-butanoate CAS Name: 2-[[(2-methoxyanilino)-sulfanylidenemethyl]amino]-3-methylbutanoic acid methyl ester IUPAC Name: methyl 2-[(2-methoxyphenyl)carbamothioylamino]-3-methylbutanoate Traditional Name: 2-[(2-methoxyphenyl)thiocarbamoylamino]-3-methyl-butyric acid methyl ester Formula: C14H20N2O3S MolecularWeight: 296.3852

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC)NC(=S)NC1=CC=CC=C1OC

Isomeric SMILES

CC(C)C(C(=O)OC)NC(=S)NC1=CC=CC=C1OC

InChI

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