9-chloranyl-2-(4-methylsulfanylphenyl)-5-naphthalen-1-yl-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine

Systemtic Name: 9-chloranyl-2-(4-methylsulfanylphenyl)-5-naphthalen-1-yl-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine Openeye Name: 9-chloro-2-(4-methylsulfanylphenyl)-5-(1-naphthyl)-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine CAS Name: 9-chloro-2-[4-(methylthio)phenyl]-5-(1-naphthalenyl)-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine IUPAC Name: 9-chloro-2-(4-methylsulfanylphenyl)-5-naphthalen-1-yl-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine Traditional Name: 9-chloro-2-[4-(methylthio)phenyl]-5-(1-naphthyl)-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine Formula: C27H21ClN2OS MolecularWeight: 456.98644

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C2=NN3C(C2)C4=C(C=CC(=C4)Cl)OC3C5=CC=CC6=CC=CC=C65

Isomeric SMILES

CSC1=CC=C(C=C1)C2=NN3C(C2)C4=C(C=CC(=C4)Cl)OC3C5=CC=CC6=CC=CC=C65

InChI

InChI=1S/C27H21ClN2OS/c1-32-20-12-9-18(10-13-20)24-16-25-23-15-19(28)11-14-26(23)31-27(30(25)29-24)22-8-4-6-17-5-2-3-7-21(17)22/h2-15,25,27H,16H2,1H3