6-[(6-chloranyl-1,3-benzodioxol-5-yl)methylsulfanyl]phenanthridine

Systemtic Name: 6-[(6-chloranyl-1,3-benzodioxol-5-yl)methylsulfanyl]phenanthridine Openeye Name: 6-[(6-chloro-1,3-benzodioxol-5-yl)methylsulfanyl]phenanthridine CAS Name: 6-[(6-chloro-1,3-benzodioxol-5-yl)methylthio]phenanthridine IUPAC Name: 6-[(6-chloro-1,3-benzodioxol-5-yl)methylsulfanyl]phenanthridine Traditional Name: 6-[(6-chloro-1,3-benzodioxol-5-yl)methylthio]phenanthridine Formula: C21H14ClNO2S MolecularWeight: 379.85936

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)CSC3=NC4=CC=CC=C4C5=CC=CC=C53)Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)CSC3=NC4=CC=CC=C4C5=CC=CC=C53)Cl

InChI

InChI=1S/C21H14ClNO2S/c22-17-10-20-19(24-12-25-20)9-13(17)11-26-21-16-7-2-1-5-14(16)15-6-3-4-8-18(15)23-21/h1-10H,11-12H2