methyl 2-[(4-carbamothioylphenyl)carbonylamino]-3-methyl-butanoate

Systemtic Name: methyl 2-[(4-carbamothioylphenyl)carbonylamino]-3-methyl-butanoate Openeye Name: methyl 2-[(4-carbamothioylbenzoyl)amino]-3-methyl-butanoate CAS Name: 2-[[(4-carbamothioylphenyl)-oxomethyl]amino]-3-methylbutanoic acid methyl ester IUPAC Name: methyl 2-[(4-carbamothioylbenzoyl)amino]-3-methylbutanoate Traditional Name: 3-methyl-2-[(4-thiocarbamoylbenzoyl)amino]butyric acid methyl ester Formula: C14H18N2O3S MolecularWeight: 294.36932

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC)NC(=O)C1=CC=C(C=C1)C(=S)N

Isomeric SMILES

CC(C)C(C(=O)OC)NC(=O)C1=CC=C(C=C1)C(=S)N

InChI

InChI=1S/C14H18N2O3S/c1-8(2)11(14(18)19-3)16-13(17)10-6-4-9(5-7-10)12(15)20/h4-8,11H,1-3H3,(H2,15,20)(H,16,17)