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

Systemtic Name: N-[4-[4-(methylsulfonylamino)phenyl]-1,3-thiazol-2-yl]-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide Openeye Name: N-[4-[4-(methanesulfonamido)phenyl]thiazol-2-yl]-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide CAS Name: N-[4-[4-(methanesulfonamido)phenyl]-2-thiazolyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-carboxamide IUPAC Name: N-[4-[4-(methanesulfonamido)phenyl]-1,3-thiazol-2-yl]-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide Traditional Name: N-[4-[4-(methanesulfonamido)phenyl]thiazol-2-yl]-3,4-dihydro-2H-1,5-benzodioxepin-7-carboxamide Formula: C20H19N3O5S2 MolecularWeight: 445.51196

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CS(=O)(=O)NC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C20H19N3O5S2/c1-30(25,26)23-15-6-3-13(4-7-15)16-12-29-20(21-16)22-19(24)14-5-8-17-18(11-14)28-10-2-9-27-17/h3-8,11-12,23H,2,9-10H2,1H3,(H,21,22,24)