N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide

Systemtic Name: N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Openeye Name: N-[4-(2-morpholinothiazol-4-yl)phenyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide CAS Name: N-[4-[2-(4-morpholinyl)-4-thiazolyl]phenyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide IUPAC Name: N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Traditional Name: N-[4-(2-morpholinothiazol-4-yl)phenyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide Formula: C22H23N3O5S2 MolecularWeight: 473.56512

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)S(=O)(=O)NC3=CC=C(C=C3)C4=CSC(=N4)N5CCOCC5)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)S(=O)(=O)NC3=CC=C(C=C3)C4=CSC(=N4)N5CCOCC5)OC1

InChI

InChI=1S/C22H23N3O5S2/c26-32(27,18-6-7-20-21(14-18)30-11-1-10-29-20)24-17-4-2-16(3-5-17)19-15-31-22(23-19)25-8-12-28-13-9-25/h2-7,14-15,24H,1,8-13H2