[2-(ethylcarbamoylamino)-2-oxidanylidene-ethyl] (2S)-2-[(3,4-dimethylphenyl)sulfonylamino]-3-methyl-butanoate

Systemtic Name: [2-(ethylcarbamoylamino)-2-oxidanylidene-ethyl] (2S)-2-[(3,4-dimethylphenyl)sulfonylamino]-3-methyl-butanoate Openeye Name: [2-(ethylcarbamoylamino)-2-oxo-ethyl] (2S)-2-[(3,4-dimethylphenyl)sulfonylamino]-3-methyl-butanoate CAS Name: (2S)-2-[(3,4-dimethylphenyl)sulfonylamino]-3-methylbutanoic acid [2-(ethylcarbamoylamino)-2-oxoethyl] ester IUPAC Name: [2-(ethylcarbamoylamino)-2-oxoethyl] (2S)-2-[(3,4-dimethylphenyl)sulfonylamino]-3-methylbutanoate Traditional Name: (2S)-2-[(3,4-dimethylphenyl)sulfonylamino]-3-methyl-butyric acid [2-(ethylcarbamoylamino)-2-keto-ethyl] ester Formula: C18H27N3O6S MolecularWeight: 413.48848

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC(=O)COC(=O)C(C(C)C)NS(=O)(=O)C1=CC(=C(C=C1)C)C

Isomeric SMILES

CCNC(=O)NC(=O)COC(=O)[C@H](C(C)C)NS(=O)(=O)C1=CC(=C(C=C1)C)C

InChI

InChI=1S/C18H27N3O6S/c1-6-19-18(24)20-15(22)10-27-17(23)16(11(2)3)21-28(25,26)14-8-7-12(4)13(5)9-14/h7-9,11,16,21H,6,10H2,1-5H3,(H2,19,20,22,24)/t16-/m0/s1