(3Z)-2-[(3-chloranyl-1-benzothiophen-2-yl)methyl]-3-diphenoxyphosphorylimino-7-methoxy-1-thiophen-2-yl-1,4-dihydroisoquinolin-6-ol

Systemtic Name: (3Z)-2-[(3-chloranyl-1-benzothiophen-2-yl)methyl]-3-diphenoxyphosphorylimino-7-methoxy-1-thiophen-2-yl-1,4-dihydroisoquinolin-6-ol Openeye Name: (3Z)-2-[(3-chlorobenzothiophen-2-yl)methyl]-3-diphenoxyphosphorylimino-7-methoxy-1-(2-thienyl)-1,4-dihydroisoquinolin-6-ol CAS Name: (3Z)-2-[(3-chloro-1-benzothiophen-2-yl)methyl]-3-diphenoxyphosphorylimino-7-methoxy-1-thiophen-2-yl-1,4-dihydroisoquinolin-6-ol IUPAC Name: (3Z)-2-[(3-chloro-1-benzothiophen-2-yl)methyl]-3-diphenoxyphosphorylimino-7-methoxy-1-thiophen-2-yl-1,4-dihydroisoquinolin-6-ol Traditional Name: (3Z)-2-[(3-chlorobenzothiophen-2-yl)methyl]-3-diphenoxyphosphorylimino-7-methoxy-1-(2-thienyl)-1,4-dihydroisoquinolin-6-ol Formula: C35H28ClN2O5PS2 MolecularWeight: 687.163981

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CC(=NP(=O)(OC3=CC=CC=C3)OC4=CC=CC=C4)N(C(C2=C1)C5=CC=CS5)CC6=C(C7=CC=CC=C7S6)Cl)O

Isomeric SMILES

COC1=C(C=C2C/C(=N/P(=O)(OC3=CC=CC=C3)OC4=CC=CC=C4)/N(C(C2=C1)C5=CC=CS5)CC6=C(C7=CC=CC=C7S6)Cl)O

InChI

InChI=1S/C35H28ClN2O5PS2/c1-41-29-21-27-23(19-28(29)39)20-33(37-44(40,42-24-11-4-2-5-12-24)43-25-13-6-3-7-14-25)38(35(27)31-17-10-18-45-31)22-32-34(36)26-15-8-9-16-30(26)46-32/h2-19,21,35,39H,20,22H2,1H3/b37-33-