(2S)-2-[(4-tert-butylphenyl)sulfonylamino]-4-methylsulfanyl-N-(1,3-thiazol-4-ylmethyl)butanamide

Systemtic Name: (2S)-2-[(4-tert-butylphenyl)sulfonylamino]-4-methylsulfanyl-N-(1,3-thiazol-4-ylmethyl)butanamide Openeye Name: (2S)-2-[(4-tert-butylphenyl)sulfonylamino]-4-methylsulfanyl-N-(thiazol-4-ylmethyl)butanamide CAS Name: (2S)-2-[(4-tert-butylphenyl)sulfonylamino]-4-(methylthio)-N-(4-thiazolylmethyl)butanamide IUPAC Name: (2S)-2-[(4-tert-butylphenyl)sulfonylamino]-4-methylsulfanyl-N-(1,3-thiazol-4-ylmethyl)butanamide Traditional Name: (2S)-2-[(4-tert-butylphenyl)sulfonylamino]-4-(methylthio)-N-(thiazol-4-ylmethyl)butyramide Formula: C19H27N3O3S3 MolecularWeight: 441.63098

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC(CCSC)C(=O)NCC2=CSC=N2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N[C@@H](CCSC)C(=O)NCC2=CSC=N2

InChI

InChI=1S/C19H27N3O3S3/c1-19(2,3)14-5-7-16(8-6-14)28(24,25)22-17(9-10-26-4)18(23)20-11-15-12-27-13-21-15/h5-8,12-13,17,22H,9-11H2,1-4H3,(H,20,23)/t17-/m0/s1