7-(2-methylphenyl)-9-(oxolan-3-yloxy)-4-thiophen-2-ylsulfonyl-3,5-dihydro-2H-1,4-benzoxazepine

Systemtic Name: 7-(2-methylphenyl)-9-(oxolan-3-yloxy)-4-thiophen-2-ylsulfonyl-3,5-dihydro-2H-1,4-benzoxazepine Openeye Name: 7-(o-tolyl)-9-tetrahydrofuran-3-yloxy-4-(2-thienylsulfonyl)-3,5-dihydro-2H-1,4-benzoxazepine CAS Name: 7-(2-methylphenyl)-9-(3-oxolanyloxy)-4-thiophen-2-ylsulfonyl-3,5-dihydro-2H-1,4-benzoxazepine IUPAC Name: 7-(2-methylphenyl)-9-(oxolan-3-yloxy)-4-thiophen-2-ylsulfonyl-3,5-dihydro-2H-1,4-benzoxazepine Traditional Name: 7-(o-tolyl)-9-tetrahydrofuran-3-yloxy-4-(2-thienylsulfonyl)-3,5-dihydro-2H-1,4-benzoxazepine Formula: C24H25NO5S2 MolecularWeight: 471.589

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=CC3=C(C(=C2)OC4CCOC4)OCCN(C3)S(=O)(=O)C5=CC=CS5

Isomeric SMILES

CC1=CC=CC=C1C2=CC3=C(C(=C2)OC4CCOC4)OCCN(C3)S(=O)(=O)C5=CC=CS5

InChI

InChI=1S/C24H25NO5S2/c1-17-5-2-3-6-21(17)18-13-19-15-25(32(26,27)23-7-4-12-31-23)9-11-29-24(19)22(14-18)30-20-8-10-28-16-20/h2-7,12-14,20H,8-11,15-16H2,1H3