methyl 2-[2-[(3,4-dimethylphenyl)carbamothioylamino]ethanoylamino]ethanoate

Systemtic Name: methyl 2-[2-[(3,4-dimethylphenyl)carbamothioylamino]ethanoylamino]ethanoate Openeye Name: methyl 2-[[2-[(3,4-dimethylphenyl)carbamothioylamino]acetyl]amino]acetate CAS Name: 2-[[2-[[(3,4-dimethylanilino)-sulfanylidenemethyl]amino]-1-oxoethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[2-[(3,4-dimethylphenyl)carbamothioylamino]acetyl]amino]acetate Traditional Name: 2-[[2-[(3,4-dimethylphenyl)thiocarbamoylamino]acetyl]amino]acetic acid methyl ester Formula: C14H19N3O3S MolecularWeight: 309.38396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NCC(=O)NCC(=O)OC)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NCC(=O)NCC(=O)OC)C

InChI

InChI=1S/C14H19N3O3S/c1-9-4-5-11(6-10(9)2)17-14(21)16-7-12(18)15-8-13(19)20-3/h4-6H,7-8H2,1-3H3,(H,15,18)(H2,16,17,21)