2-(phenylmethyl)-1-(phenylsulfanylmethyl)-1,4-dihydroisoquinolin-3-one

Systemtic Name: 2-(phenylmethyl)-1-(phenylsulfanylmethyl)-1,4-dihydroisoquinolin-3-one Openeye Name: 2-benzyl-1-(phenylsulfanylmethyl)-1,4-dihydroisoquinolin-3-one CAS Name: 2-(phenylmethyl)-1-[(phenylthio)methyl]-1,4-dihydroisoquinolin-3-one IUPAC Name: 2-benzyl-1-(phenylsulfanylmethyl)-1,4-dihydroisoquinolin-3-one Traditional Name: 2-benzyl-1-[(phenylthio)methyl]-1,4-dihydroisoquinolin-3-one Formula: C23H21NOS MolecularWeight: 359.48394

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(N(C1=O)CC3=CC=CC=C3)CSC4=CC=CC=C4

Isomeric SMILES

C1C2=CC=CC=C2C(N(C1=O)CC3=CC=CC=C3)CSC4=CC=CC=C4

InChI

InChI=1S/C23H21NOS/c25-23-15-19-11-7-8-14-21(19)22(17-26-20-12-5-2-6-13-20)24(23)16-18-9-3-1-4-10-18/h1-14,22H,15-17H2