[1-[(4-methoxyphenyl)methylamino]-1-oxidanylidene-propan-2-yl] 3-methyl-2-(thiophen-2-ylcarbonylamino)butanoate

Systemtic Name: [1-[(4-methoxyphenyl)methylamino]-1-oxidanylidene-propan-2-yl] 3-methyl-2-(thiophen-2-ylcarbonylamino)butanoate Openeye Name: [2-[(4-methoxyphenyl)methylamino]-1-methyl-2-oxo-ethyl] 3-methyl-2-(thiophene-2-carbonylamino)butanoate CAS Name: 3-methyl-2-[[oxo(thiophen-2-yl)methyl]amino]butanoic acid [1-[(4-methoxyphenyl)methylamino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[(4-methoxyphenyl)methylamino]-1-oxopropan-2-yl] 3-methyl-2-(thiophene-2-carbonylamino)butanoate Traditional Name: 3-methyl-2-(2-thenoylamino)butyric acid [2-keto-1-methyl-2-(p-anisylamino)ethyl] ester Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC(C)C(=O)NCC1=CC=C(C=C1)OC)NC(=O)C2=CC=CS2

Isomeric SMILES

CC(C)C(C(=O)OC(C)C(=O)NCC1=CC=C(C=C1)OC)NC(=O)C2=CC=CS2

InChI

InChI=1S/C21H26N2O5S/c1-13(2)18(23-20(25)17-6-5-11-29-17)21(26)28-14(3)19(24)22-12-15-7-9-16(27-4)10-8-15/h5-11,13-14,18H,12H2,1-4H3,(H,22,24)(H,23,25)