(2S)-N-[2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl]-3-methyl-2-(2-phenoxyethanoylamino)butanamide

Systemtic Name: (2S)-N-[2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl]-3-methyl-2-(2-phenoxyethanoylamino)butanamide Openeye Name: (2S)-N-[2-(2-ethylanilino)-2-oxo-ethyl]-3-methyl-2-[(2-phenoxyacetyl)amino]butanamide CAS Name: (2S)-N-[2-(2-ethylanilino)-2-oxoethyl]-3-methyl-2-[(1-oxo-2-phenoxyethyl)amino]butanamide IUPAC Name: (2S)-N-[2-(2-ethylanilino)-2-oxoethyl]-3-methyl-2-[(2-phenoxyacetyl)amino]butanamide Traditional Name: (2S)-N-[2-(2-ethylanilino)-2-keto-ethyl]-3-methyl-2-[(2-phenoxyacetyl)amino]butyramide Formula: C23H29N3O4 MolecularWeight: 411.49406

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)CNC(=O)C(C(C)C)NC(=O)COC2=CC=CC=C2

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)CNC(=O)[C@H](C(C)C)NC(=O)COC2=CC=CC=C2

InChI

InChI=1S/C23H29N3O4/c1-4-17-10-8-9-13-19(17)25-20(27)14-24-23(29)22(16(2)3)26-21(28)15-30-18-11-6-5-7-12-18/h5-13,16,22H,4,14-15H2,1-3H3,(H,24,29)(H,25,27)(H,26,28)/t22-/m0/s1