(2S)-2-[(3-chloranyl-4-methoxy-phenyl)sulfonylamino]-4-methylsulfanyl-N-(1,3-thiazol-4-ylmethyl)butanamide

Systemtic Name: (2S)-2-[(3-chloranyl-4-methoxy-phenyl)sulfonylamino]-4-methylsulfanyl-N-(1,3-thiazol-4-ylmethyl)butanamide Openeye Name: (2S)-2-[(3-chloro-4-methoxy-phenyl)sulfonylamino]-4-methylsulfanyl-N-(thiazol-4-ylmethyl)butanamide CAS Name: (2S)-2-[(3-chloro-4-methoxyphenyl)sulfonylamino]-4-(methylthio)-N-(4-thiazolylmethyl)butanamide IUPAC Name: (2S)-2-[(3-chloro-4-methoxyphenyl)sulfonylamino]-4-methylsulfanyl-N-(1,3-thiazol-4-ylmethyl)butanamide Traditional Name: (2S)-2-[(3-chloro-4-methoxy-phenyl)sulfonylamino]-4-(methylthio)-N-(thiazol-4-ylmethyl)butyramide Formula: C16H20ClN3O4S3 MolecularWeight: 449.9957

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NC(CCSC)C(=O)NCC2=CSC=N2)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N[C@@H](CCSC)C(=O)NCC2=CSC=N2)Cl

InChI

InChI=1S/C16H20ClN3O4S3/c1-24-15-4-3-12(7-13(15)17)27(22,23)20-14(5-6-25-2)16(21)18-8-11-9-26-10-19-11/h3-4,7,9-10,14,20H,5-6,8H2,1-2H3,(H,18,21)/t14-/m0/s1