7-ethoxy-2-(3-methoxyphenyl)-5-(4-methylsulfanylphenyl)-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine

Systemtic Name: 7-ethoxy-2-(3-methoxyphenyl)-5-(4-methylsulfanylphenyl)-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine Openeye Name: 7-ethoxy-2-(3-methoxyphenyl)-5-(4-methylsulfanylphenyl)-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine CAS Name: 7-ethoxy-2-(3-methoxyphenyl)-5-[4-(methylthio)phenyl]-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine IUPAC Name: 7-ethoxy-2-(3-methoxyphenyl)-5-(4-methylsulfanylphenyl)-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine Traditional Name: 7-ethoxy-2-(3-methoxyphenyl)-5-[4-(methylthio)phenyl]-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine Formula: C26H26N2O3S MolecularWeight: 446.56124

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC2=C1OC(N3C2CC(=N3)C4=CC(=CC=C4)OC)C5=CC=C(C=C5)SC

Isomeric SMILES

CCOC1=CC=CC2=C1OC(N3C2CC(=N3)C4=CC(=CC=C4)OC)C5=CC=C(C=C5)SC

InChI

InChI=1S/C26H26N2O3S/c1-4-30-24-10-6-9-21-23-16-22(18-7-5-8-19(15-18)29-2)27-28(23)26(31-25(21)24)17-11-13-20(32-3)14-12-17/h5-15,23,26H,4,16H2,1-3H3