(2S)-2-azanyl-N-[2-chloranyl-4-(3-phenylmethoxyphenyl)sulfanyl-phenyl]-2-methyl-3-oxidanyl-propanamide

Systemtic Name: (2S)-2-azanyl-N-[2-chloranyl-4-(3-phenylmethoxyphenyl)sulfanyl-phenyl]-2-methyl-3-oxidanyl-propanamide Openeye Name: (2S)-2-amino-N-[4-(3-benzyloxyphenyl)sulfanyl-2-chloro-phenyl]-3-hydroxy-2-methyl-propanamide CAS Name: (2S)-2-amino-N-[2-chloro-4-[(3-phenylmethoxyphenyl)thio]phenyl]-3-hydroxy-2-methylpropanamide IUPAC Name: (2S)-2-amino-N-[2-chloro-4-(3-phenylmethoxyphenyl)sulfanylphenyl]-3-hydroxy-2-methylpropanamide Traditional Name: (2S)-2-amino-N-[4-[(3-benzoxyphenyl)thio]-2-chloro-phenyl]-3-hydroxy-2-methyl-propionamide Formula: C23H23ClN2O3S MolecularWeight: 442.95832

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)(C(=O)NC1=C(C=C(C=C1)SC2=CC=CC(=C2)OCC3=CC=CC=C3)Cl)N

Isomeric SMILES

C[C@](CO)(C(=O)NC1=C(C=C(C=C1)SC2=CC=CC(=C2)OCC3=CC=CC=C3)Cl)N

InChI

InChI=1S/C23H23ClN2O3S/c1-23(25,15-27)22(28)26-21-11-10-19(13-20(21)24)30-18-9-5-8-17(12-18)29-14-16-6-3-2-4-7-16/h2-13,27H,14-15,25H2,1H3,(H,26,28)/t23-/m0/s1