tert-butyl (E)-5-[4-methylpentanoyl-(2-methylpropylamino)amino]-2-thiophen-2-yl-pent-2-enoate

Systemtic Name: tert-butyl (E)-5-[4-methylpentanoyl-(2-methylpropylamino)amino]-2-thiophen-2-yl-pent-2-enoate Openeye Name: tert-butyl (E)-5-[(isobutylamino)-(4-methylpentanoyl)amino]-2-(2-thienyl)pent-2-enoate CAS Name: (E)-5-[(4-methyl-1-oxopentyl)-(2-methylpropylamino)amino]-2-thiophen-2-yl-2-pentenoic acid tert-butyl ester IUPAC Name: tert-butyl (E)-5-[4-methylpentanoyl-(2-methylpropylamino)amino]-2-thiophen-2-ylpent-2-enoate Traditional Name: (E)-5-[(isobutylamino)-(4-methylpentanoyl)amino]-2-(2-thienyl)pent-2-enoic acid tert-butyl ester Formula: C23H38N2O3S MolecularWeight: 422.62442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(=O)N(CCC=C(C1=CC=CS1)C(=O)OC(C)(C)C)NCC(C)C

Isomeric SMILES

CC(C)CCC(=O)N(CC/C=C(/C1=CC=CS1)\C(=O)OC(C)(C)C)NCC(C)C

InChI

InChI=1S/C23H38N2O3S/c1-17(2)12-13-21(26)25(24-16-18(3)4)14-8-10-19(20-11-9-15-29-20)22(27)28-23(5,6)7/h9-11,15,17-18,24H,8,12-14,16H2,1-7H3/b19-10-