N-(2-chlorophenyl)-2-[(1R)-1-cyanoethyl]sulfanyl-1,3-benzoxazole-5-sulfonamide

Systemtic Name: N-(2-chlorophenyl)-2-[(1R)-1-cyanoethyl]sulfanyl-1,3-benzoxazole-5-sulfonamide Openeye Name: N-(2-chlorophenyl)-2-[(1R)-1-cyanoethyl]sulfanyl-1,3-benzoxazole-5-sulfonamide CAS Name: N-(2-chlorophenyl)-2-[[(1R)-1-cyanoethyl]thio]-1,3-benzoxazole-5-sulfonamide IUPAC Name: N-(2-chlorophenyl)-2-[(1R)-1-cyanoethyl]sulfanyl-1,3-benzoxazole-5-sulfonamide Traditional Name: N-(2-chlorophenyl)-2-[[(1R)-1-cyanoethyl]thio]-1,3-benzoxazole-5-sulfonamide Formula: C16H12ClN3O3S2 MolecularWeight: 393.86778

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)SC1=NC2=C(O1)C=CC(=C2)S(=O)(=O)NC3=CC=CC=C3Cl

Isomeric SMILES

C[C@H](C#N)SC1=NC2=C(O1)C=CC(=C2)S(=O)(=O)NC3=CC=CC=C3Cl

InChI

InChI=1S/C16H12ClN3O3S2/c1-10(9-18)24-16-19-14-8-11(6-7-15(14)23-16)25(21,22)20-13-5-3-2-4-12(13)17/h2-8,10,20H,1H3/t10-/m1/s1