bicyclo[2.2.0]hexa-1(4),2,5-triene; 2-[(2,4-dichlorophenyl)methylsulfanyl]-4-(diethylamino)butan-2-ol

Systemtic Name: bicyclo[2.2.0]hexa-1(4),2,5-triene; 2-[(2,4-dichlorophenyl)methylsulfanyl]-4-(diethylamino)butan-2-ol Openeye Name: bicyclo[2.2.0]hexa-1(4),2,5-triene; 2-[(2,4-dichlorophenyl)methylsulfanyl]-4-(diethylamino)butan-2-ol CAS Name: bicyclo[2.2.0]hexa-1(4),2,5-triene; 2-[(2,4-dichlorophenyl)methylthio]-4-(diethylamino)-2-butanol IUPAC Name: bicyclo[2.2.0]hexa-1(4),2,5-triene; 2-[(2,4-dichlorophenyl)methylsulfanyl]-4-(diethylamino)butan-2-ol Traditional Name: bicyclo[2.2.0]hexa-1(4),2,5-triene; 2-[(2,4-dichlorobenzyl)thio]-4-(diethylamino)butan-2-ol Formula: C21H27Cl2NOS MolecularWeight: 412.41618

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCC(C)(O)SCC1=C(C=C(C=C1)Cl)Cl.C1=CC2=C1C=C2

Isomeric SMILES

CCN(CC)CCC(C)(O)SCC1=C(C=C(C=C1)Cl)Cl.C1=CC2=C1C=C2

InChI

InChI=1S/C15H23Cl2NOS.C6H4/c1-4-18(5-2)9-8-15(3,19)20-11-12-6-7-13(16)10-14(12)17;1-2-6-4-3-5(1)6/h6-7,10,19H,4-5,8-9,11H2,1-3H3;1-4H