5-(3-chloranyl-1-benzothiophen-2-yl)-3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-1,3,4-oxadiazole-2-thione

Systemtic Name: 5-(3-chloranyl-1-benzothiophen-2-yl)-3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-1,3,4-oxadiazole-2-thione Openeye Name: 5-(3-chlorobenzothiophen-2-yl)-3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-1,3,4-oxadiazole-2-thione CAS Name: 5-(3-chloro-1-benzothiophen-2-yl)-3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-1,3,4-oxadiazole-2-thione IUPAC Name: 5-(3-chloro-1-benzothiophen-2-yl)-3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-1,3,4-oxadiazole-2-thione Traditional Name: 5-(3-chlorobenzothiophen-2-yl)-3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-1,3,4-oxadiazole-2-thione Formula: C20H16ClN3OS2 MolecularWeight: 413.94354

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)CN3C(=S)OC(=N3)C4=C(C5=CC=CC=C5S4)Cl

Isomeric SMILES

C1CN(CC2=CC=CC=C21)CN3C(=S)OC(=N3)C4=C(C5=CC=CC=C5S4)Cl

InChI

InChI=1S/C20H16ClN3OS2/c21-17-15-7-3-4-8-16(15)27-18(17)19-22-24(20(26)25-19)12-23-10-9-13-5-1-2-6-14(13)11-23/h1-8H,9-12H2