4-[3-[2-(2-chloranyl-3,4-dimethoxy-phenyl)ethylamino]-2-phenyl-propyl]cyclohexa-2,4-diene-1-thione

Systemtic Name: 4-[3-[2-(2-chloranyl-3,4-dimethoxy-phenyl)ethylamino]-2-phenyl-propyl]cyclohexa-2,4-diene-1-thione Openeye Name: 4-[3-[2-(2-chloro-3,4-dimethoxy-phenyl)ethylamino]-2-phenyl-propyl]cyclohexa-2,4-diene-1-thione CAS Name: 4-[3-[2-(2-chloro-3,4-dimethoxyphenyl)ethylamino]-2-phenylpropyl]-1-cyclohexa-2,4-dienethione IUPAC Name: 4-[3-[2-(2-chloro-3,4-dimethoxyphenyl)ethylamino]-2-phenylpropyl]cyclohexa-2,4-diene-1-thione Traditional Name: 4-[3-[2-(2-chloro-3,4-dimethoxy-phenyl)ethylamino]-2-phenyl-propyl]cyclohexa-2,4-diene-1-thione Formula: C25H28ClNO2S MolecularWeight: 442.01332

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)CCNCC(CC2=CCC(=S)C=C2)C3=CC=CC=C3)Cl)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)CCNCC(CC2=CCC(=S)C=C2)C3=CC=CC=C3)Cl)OC

InChI

InChI=1S/C25H28ClNO2S/c1-28-23-13-10-20(24(26)25(23)29-2)14-15-27-17-21(19-6-4-3-5-7-19)16-18-8-11-22(30)12-9-18/h3-11,13,21,27H,12,14-17H2,1-2H3