(2R)-2-[[2-(cyclobutylcarbonylamino)-4-sulfanyl-butanoyl]amino]-3-phenyl-propanoic acid

Systemtic Name: (2R)-2-[[2-(cyclobutylcarbonylamino)-4-sulfanyl-butanoyl]amino]-3-phenyl-propanoic acid Openeye Name: (2R)-2-[[2-(cyclobutanecarbonylamino)-4-sulfanyl-butanoyl]amino]-3-phenyl-propanoic acid CAS Name: (2R)-2-[[2-[[cyclobutyl(oxo)methyl]amino]-4-mercapto-1-oxobutyl]amino]-3-phenylpropanoic acid IUPAC Name: (2R)-2-[[2-(cyclobutanecarbonylamino)-4-sulfanylbutanoyl]amino]-3-phenylpropanoic acid Traditional Name: (2R)-2-[[2-(cyclobutanecarbonylamino)-4-mercapto-butanoyl]amino]-3-phenyl-propionic acid Formula: C18H24N2O4S MolecularWeight: 364.45916

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)C(=O)NC(CCS)C(=O)NC(CC2=CC=CC=C2)C(=O)O

Isomeric SMILES

C1CC(C1)C(=O)NC(CCS)C(=O)N[C@H](CC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C18H24N2O4S/c21-16(13-7-4-8-13)19-14(9-10-25)17(22)20-15(18(23)24)11-12-5-2-1-3-6-12/h1-3,5-6,13-15,25H,4,7-11H2,(H,19,21)(H,20,22)(H,23,24)/t14?,15-/m1/s1