[2-[tert-butyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl] 3-methyl-2-(thiophen-2-ylcarbonylamino)butanoate

Systemtic Name: [2-[tert-butyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl] 3-methyl-2-(thiophen-2-ylcarbonylamino)butanoate Openeye Name: [2-[benzyl(tert-butyl)amino]-2-oxo-ethyl] 3-methyl-2-(thiophene-2-carbonylamino)butanoate CAS Name: 3-methyl-2-[[oxo(thiophen-2-yl)methyl]amino]butanoic acid [2-[tert-butyl-(phenylmethyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[benzyl(tert-butyl)amino]-2-oxoethyl] 3-methyl-2-(thiophene-2-carbonylamino)butanoate Traditional Name: 3-methyl-2-(2-thenoylamino)butyric acid [2-[benzyl(tert-butyl)amino]-2-keto-ethyl] ester Formula: C23H30N2O4S MolecularWeight: 430.5603

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC(=O)N(CC1=CC=CC=C1)C(C)(C)C)NC(=O)C2=CC=CS2

Isomeric SMILES

CC(C)C(C(=O)OCC(=O)N(CC1=CC=CC=C1)C(C)(C)C)NC(=O)C2=CC=CS2

InChI

InChI=1S/C23H30N2O4S/c1-16(2)20(24-21(27)18-12-9-13-30-18)22(28)29-15-19(26)25(23(3,4)5)14-17-10-7-6-8-11-17/h6-13,16,20H,14-15H2,1-5H3,(H,24,27)