2-ethyl-3-(4-methoxyphenyl)isoquinoline-1-thione

Systemtic Name: 2-ethyl-3-(4-methoxyphenyl)isoquinoline-1-thione Openeye Name: 2-ethyl-3-(4-methoxyphenyl)isoquinoline-1-thione CAS Name: 2-ethyl-3-(4-methoxyphenyl)-1-isoquinolinethione IUPAC Name: 2-ethyl-3-(4-methoxyphenyl)isoquinoline-1-thione Traditional Name: 2-ethyl-3-(4-methoxyphenyl)isoquinoline-1-thione Formula: C18H17NOS MolecularWeight: 295.39868

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC2=CC=CC=C2C1=S)C3=CC=C(C=C3)OC

Isomeric SMILES

CCN1C(=CC2=CC=CC=C2C1=S)C3=CC=C(C=C3)OC

InChI

InChI=1S/C18H17NOS/c1-3-19-17(13-8-10-15(20-2)11-9-13)12-14-6-4-5-7-16(14)18(19)21/h4-12H,3H2,1-2H3