2-azanyl-2-[2-[2-chloranyl-4-(3-phenoxyphenyl)sulfanyl-phenyl]ethyl]propane-1,3-diol

Systemtic Name: 2-azanyl-2-[2-[2-chloranyl-4-(3-phenoxyphenyl)sulfanyl-phenyl]ethyl]propane-1,3-diol Openeye Name: 2-amino-2-[2-[2-chloro-4-(3-phenoxyphenyl)sulfanyl-phenyl]ethyl]propane-1,3-diol CAS Name: 2-amino-2-[2-[2-chloro-4-[(3-phenoxyphenyl)thio]phenyl]ethyl]propane-1,3-diol IUPAC Name: 2-amino-2-[2-[2-chloro-4-(3-phenoxyphenyl)sulfanylphenyl]ethyl]propane-1,3-diol Traditional Name: 2-amino-2-[2-[2-chloro-4-[(3-phenoxyphenyl)thio]phenyl]ethyl]propane-1,3-diol Formula: C23H24ClNO3S MolecularWeight: 429.95956

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC(=CC=C2)SC3=CC(=C(C=C3)CCC(CO)(CO)N)Cl

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC(=CC=C2)SC3=CC(=C(C=C3)CCC(CO)(CO)N)Cl

InChI

InChI=1S/C23H24ClNO3S/c24-22-14-21(10-9-17(22)11-12-23(25,15-26)16-27)29-20-8-4-7-19(13-20)28-18-5-2-1-3-6-18/h1-10,13-14,26-27H,11-12,15-16,25H2