S-(3,4-dihydroisoquinolin-1-yl) benzenecarbothioate

Systemtic Name: S-(3,4-dihydroisoquinolin-1-yl) benzenecarbothioate Openeye Name: S-(3,4-dihydroisoquinolin-1-yl) benzenecarbothioate CAS Name: benzenecarbothioic acid S-(3,4-dihydroisoquinolin-1-yl) ester IUPAC Name: S-(3,4-dihydroisoquinolin-1-yl) benzenecarbothioate Traditional Name: thiobenzoic acid S-(3,4-dihydroisoquinolin-1-yl) ester Formula: C16H13NOS MolecularWeight: 267.34552

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Descriptors Computed from Structure

Canonical SMILES:

C1CN=C(C2=CC=CC=C21)SC(=O)C3=CC=CC=C3

Isomeric SMILES

C1CN=C(C2=CC=CC=C21)SC(=O)C3=CC=CC=C3

InChI

InChI=1S/C16H13NOS/c18-16(13-7-2-1-3-8-13)19-15-14-9-5-4-6-12(14)10-11-17-15/h1-9H,10-11H2