methyl (2R)-2-[2-[4-(1,3-benzothiazol-2-yl)butanoyloxy]ethanoylamino]-4-methyl-pentanoate

Systemtic Name: methyl (2R)-2-[2-[4-(1,3-benzothiazol-2-yl)butanoyloxy]ethanoylamino]-4-methyl-pentanoate Openeye Name: methyl (2R)-2-[[2-[4-(1,3-benzothiazol-2-yl)butanoyloxy]acetyl]amino]-4-methyl-pentanoate CAS Name: (2R)-2-[[2-[4-(1,3-benzothiazol-2-yl)-1-oxobutoxy]-1-oxoethyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[2-[4-(1,3-benzothiazol-2-yl)butanoyloxy]acetyl]amino]-4-methylpentanoate Traditional Name: (2R)-2-[[2-[4-(1,3-benzothiazol-2-yl)butanoyloxy]acetyl]amino]-4-methyl-valeric acid methyl ester Formula: C20H26N2O5S MolecularWeight: 406.49584

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NC(=O)COC(=O)CCCC1=NC2=CC=CC=C2S1

Isomeric SMILES

CC(C)C[C@H](C(=O)OC)NC(=O)COC(=O)CCCC1=NC2=CC=CC=C2S1

InChI

InChI=1S/C20H26N2O5S/c1-13(2)11-15(20(25)26-3)21-17(23)12-27-19(24)10-6-9-18-22-14-7-4-5-8-16(14)28-18/h4-5,7-8,13,15H,6,9-12H2,1-3H3,(H,21,23)/t15-/m1/s1