methyl (2R)-3-methyl-2-[[5-[2-(4-methylphenyl)ethynyl]thiophen-2-yl]sulfonylamino]butanoate

Systemtic Name: methyl (2R)-3-methyl-2-[[5-[2-(4-methylphenyl)ethynyl]thiophen-2-yl]sulfonylamino]butanoate Openeye Name: methyl (2R)-3-methyl-2-[[5-[2-(p-tolyl)ethynyl]-2-thienyl]sulfonylamino]butanoate CAS Name: (2R)-3-methyl-2-[[5-[2-(4-methylphenyl)ethynyl]-2-thiophenyl]sulfonylamino]butanoic acid methyl ester IUPAC Name: methyl (2R)-3-methyl-2-[[5-[2-(4-methylphenyl)ethynyl]thiophen-2-yl]sulfonylamino]butanoate Traditional Name: (2R)-3-methyl-2-[[5-[2-(p-tolyl)ethynyl]-2-thienyl]sulfonylamino]butyric acid methyl ester Formula: C19H21NO4S2 MolecularWeight: 391.50434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C#CC2=CC=C(S2)S(=O)(=O)NC(C(C)C)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C#CC2=CC=C(S2)S(=O)(=O)N[C@H](C(C)C)C(=O)OC

InChI

InChI=1S/C19H21NO4S2/c1-13(2)18(19(21)24-4)20-26(22,23)17-12-11-16(25-17)10-9-15-7-5-14(3)6-8-15/h5-8,11-13,18,20H,1-4H3/t18-/m1/s1