5-(3-bromanyl-4-methoxy-phenyl)-9-chloranyl-2-thiophen-2-yl-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine

Systemtic Name: 5-(3-bromanyl-4-methoxy-phenyl)-9-chloranyl-2-thiophen-2-yl-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine Openeye Name: 5-(3-bromo-4-methoxy-phenyl)-9-chloro-2-(2-thienyl)-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine CAS Name: 5-(3-bromo-4-methoxyphenyl)-9-chloro-2-thiophen-2-yl-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine IUPAC Name: 5-(3-bromo-4-methoxyphenyl)-9-chloro-2-thiophen-2-yl-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine Traditional Name: 5-(3-bromo-4-methoxy-phenyl)-9-chloro-2-(2-thienyl)-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine Formula: C21H16BrClN2O2S MolecularWeight: 475.78594

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2N3C(CC(=N3)C4=CC=CS4)C5=C(O2)C=CC(=C5)Cl)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C2N3C(CC(=N3)C4=CC=CS4)C5=C(O2)C=CC(=C5)Cl)Br

InChI

InChI=1S/C21H16BrClN2O2S/c1-26-19-6-4-12(9-15(19)22)21-25-17(11-16(24-25)20-3-2-8-28-20)14-10-13(23)5-7-18(14)27-21/h2-10,17,21H,11H2,1H3