6-chloranyl-3-(3,4-dihydro-1H-isoquinolin-2-yl)thiochromen-4-one

Systemtic Name: 6-chloranyl-3-(3,4-dihydro-1H-isoquinolin-2-yl)thiochromen-4-one Openeye Name: 6-chloro-3-(3,4-dihydro-1H-isoquinolin-2-yl)thiochromen-4-one CAS Name: 6-chloro-3-(3,4-dihydro-1H-isoquinolin-2-yl)-1-benzothiopyran-4-one IUPAC Name: 6-chloro-3-(3,4-dihydro-1H-isoquinolin-2-yl)thiochromen-4-one Traditional Name: 6-chloro-3-(3,4-dihydro-1H-isoquinolin-2-yl)thiochromen-4-one Formula: C18H14ClNOS MolecularWeight: 327.82786

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C3=CSC4=C(C3=O)C=C(C=C4)Cl

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C3=CSC4=C(C3=O)C=C(C=C4)Cl

InChI

InChI=1S/C18H14ClNOS/c19-14-5-6-17-15(9-14)18(21)16(11-22-17)20-8-7-12-3-1-2-4-13(12)10-20/h1-6,9,11H,7-8,10H2