2-azanyl-5-[2-chloranyl-4-(4-phenylphenyl)sulfanyl-phenyl]pentan-1-ol hydrochloride

Systemtic Name: 2-azanyl-5-[2-chloranyl-4-(4-phenylphenyl)sulfanyl-phenyl]pentan-1-ol hydrochloride Openeye Name: 2-amino-5-[2-chloro-4-(4-phenylphenyl)sulfanyl-phenyl]pentan-1-ol hydrochloride CAS Name: 2-amino-5-[2-chloro-4-[(4-phenylphenyl)thio]phenyl]-1-pentanol hydrochloride IUPAC Name: 2-amino-5-[2-chloro-4-(4-phenylphenyl)sulfanylphenyl]pentan-1-ol hydrochloride Traditional Name: 2-amino-5-[2-chloro-4-[(4-phenylphenyl)thio]phenyl]pentan-1-ol hydrochloride Formula: C23H25Cl2NOS MolecularWeight: 434.4217

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H24ClNOS.ClH/c24-23-15-22(14-11-19(23)7-4-8-20(25)16-26)27-21-12-9-18(10-13-21)17-5-2-1-3-6-17;/h1-3,5-6,9-15,20,26H,4,7-8,16,25H2;1H