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

Systemtic Name: 5-(2-bromanyl-4,5-dimethoxy-phenyl)-2-thiophen-2-yl-5,10b-dihydro-3H-pyrazolo[1,5-c][1,3]benzoxazine Openeye Name: 5-(2-bromo-4,5-dimethoxy-phenyl)-2-(2-thienyl)-5,10b-dihydro-3H-pyrazolo[1,5-c][1,3]benzoxazine CAS Name: 5-(2-bromo-4,5-dimethoxyphenyl)-2-thiophen-2-yl-5,10b-dihydro-3H-pyrazolo[1,5-c][1,3]benzoxazine IUPAC Name: 5-(2-bromo-4,5-dimethoxyphenyl)-2-thiophen-2-yl-5,10b-dihydro-3H-pyrazolo[1,5-c][1,3]benzoxazine Traditional Name: 5-(2-bromo-4,5-dimethoxy-phenyl)-2-(2-thienyl)-5,10b-dihydro-3H-pyrazolo[1,5-c][1,3]benzoxazine Formula: C22H19BrN2O3S MolecularWeight: 471.36686

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C2N3C(C=C(N3)C4=CC=CS4)C5=CC=CC=C5O2)Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C2N3C(C=C(N3)C4=CC=CS4)C5=CC=CC=C5O2)Br)OC

InChI

InChI=1S/C22H19BrN2O3S/c1-26-19-10-14(15(23)11-20(19)27-2)22-25-17(13-6-3-4-7-18(13)28-22)12-16(24-25)21-8-5-9-29-21/h3-12,17,22,24H,1-2H3