S-[2-[[(2S)-1-azanyl-1-oxidanylidene-pentan-2-yl]carbamoyl]phenyl] 2,2-dimethylpropanethioate

Systemtic Name: S-[2-[[(2S)-1-azanyl-1-oxidanylidene-pentan-2-yl]carbamoyl]phenyl] 2,2-dimethylpropanethioate Openeye Name: S-[2-[[(1S)-1-carbamoylbutyl]carbamoyl]phenyl] 2,2-dimethylpropanethioate CAS Name: 2,2-dimethylpropanethioic acid S-[2-[[[(2S)-1-amino-1-oxopentan-2-yl]amino]-oxomethyl]phenyl] ester IUPAC Name: S-[2-[[(2S)-1-amino-1-oxopentan-2-yl]carbamoyl]phenyl] 2,2-dimethylpropanethioate Traditional Name: 2,2-dimethylpropanethioic acid S-[2-[[(1S)-1-carbamoylbutyl]carbamoyl]phenyl] ester Formula: C17H24N2O3S MolecularWeight: 336.44906

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)N)NC(=O)C1=CC=CC=C1SC(=O)C(C)(C)C

Isomeric SMILES

CCC[C@@H](C(=O)N)NC(=O)C1=CC=CC=C1SC(=O)C(C)(C)C

InChI

InChI=1S/C17H24N2O3S/c1-5-8-12(14(18)20)19-15(21)11-9-6-7-10-13(11)23-16(22)17(2,3)4/h6-7,9-10,12H,5,8H2,1-4H3,(H2,18,20)(H,19,21)/t12-/m0/s1