2-azanyl-4-[2-chloranyl-4-(3-phenylmethoxyphenyl)sulfanyl-phenyl]-2-(phosphonatomethyl)butan-1-ol

Systemtic Name: 2-azanyl-4-[2-chloranyl-4-(3-phenylmethoxyphenyl)sulfanyl-phenyl]-2-(phosphonatomethyl)butan-1-ol Openeye Name: 2-amino-4-[4-(3-benzyloxyphenyl)sulfanyl-2-chloro-phenyl]-2-(phosphonatomethyl)butan-1-ol CAS Name: 2-amino-4-[2-chloro-4-[(3-phenylmethoxyphenyl)thio]phenyl]-2-(phosphonatomethyl)-1-butanol IUPAC Name: 2-amino-4-[2-chloro-4-(3-phenylmethoxyphenyl)sulfanylphenyl]-2-(phosphonatomethyl)butan-1-ol Traditional Name: 2-amino-4-[4-[(3-benzoxyphenyl)thio]-2-chloro-phenyl]-2-(phosphonatomethyl)butan-1-ol Formula: C24H25ClNO5PS-2 MolecularWeight: 505.950761

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC(=CC=C2)SC3=CC(=C(C=C3)CCC(CO)(CP(=O)([O-])[O-])N)Cl

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC(=CC=C2)SC3=CC(=C(C=C3)CCC(CO)(CP(=O)([O-])[O-])N)Cl

InChI

InChI=1S/C24H27ClNO5PS/c25-23-14-22(10-9-19(23)11-12-24(26,16-27)17-32(28,29)30)33-21-8-4-7-20(13-21)31-15-18-5-2-1-3-6-18/h1-10,13-14,27H,11-12,15-17,26H2,(H2,28,29,30)/p-2