(2S)-N-ethyl-2-[2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoylamino]propanamide

Systemtic Name: (2S)-N-ethyl-2-[2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoylamino]propanamide Openeye Name: (2S)-N-ethyl-2-[[2-[2-(4-methylanilino)-2-oxo-ethyl]sulfanylacetyl]amino]propanamide CAS Name: (2S)-N-ethyl-2-[[2-[[2-(4-methylanilino)-2-oxoethyl]thio]-1-oxoethyl]amino]propanamide IUPAC Name: (2S)-N-ethyl-2-[[2-[2-(4-methylanilino)-2-oxoethyl]sulfanylacetyl]amino]propanamide Traditional Name: (2S)-N-ethyl-2-[[2-[[2-keto-2-(p-toluidino)ethyl]thio]acetyl]amino]propionamide Formula: C16H23N3O3S MolecularWeight: 337.43712

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)NC(=O)CSCC(=O)NC1=CC=C(C=C1)C

Isomeric SMILES

CCNC(=O)[C@H](C)NC(=O)CSCC(=O)NC1=CC=C(C=C1)C

InChI

InChI=1S/C16H23N3O3S/c1-4-17-16(22)12(3)18-14(20)9-23-10-15(21)19-13-7-5-11(2)6-8-13/h5-8,12H,4,9-10H2,1-3H3,(H,17,22)(H,18,20)(H,19,21)/t12-/m0/s1