2-azanyl-2-[3-[4-(3-phenylmethoxyphenyl)sulfanylphenyl]propyl]propane-1,3-diol

Systemtic Name: 2-azanyl-2-[3-[4-(3-phenylmethoxyphenyl)sulfanylphenyl]propyl]propane-1,3-diol Openeye Name: 2-amino-2-[3-[4-(3-benzyloxyphenyl)sulfanylphenyl]propyl]propane-1,3-diol CAS Name: 2-amino-2-[3-[4-[(3-phenylmethoxyphenyl)thio]phenyl]propyl]propane-1,3-diol IUPAC Name: 2-amino-2-[3-[4-(3-phenylmethoxyphenyl)sulfanylphenyl]propyl]propane-1,3-diol Traditional Name: 2-amino-2-[3-[4-[(3-benzoxyphenyl)thio]phenyl]propyl]propane-1,3-diol Formula: C25H29NO3S MolecularWeight: 423.56766

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC(=CC=C2)SC3=CC=C(C=C3)CCCC(CO)(CO)N

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC(=CC=C2)SC3=CC=C(C=C3)CCCC(CO)(CO)N

InChI

InChI=1S/C25H29NO3S/c26-25(18-27,19-28)15-5-8-20-11-13-23(14-12-20)30-24-10-4-9-22(16-24)29-17-21-6-2-1-3-7-21/h1-4,6-7,9-14,16,27-28H,5,8,15,17-19,26H2