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

Systemtic Name: N-[2-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]ethyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Openeye Name: N-[2-[4-(2-methylthiazol-4-yl)phenyl]ethyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide CAS Name: N-[2-[4-(2-methyl-4-thiazolyl)phenyl]ethyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide IUPAC Name: N-[2-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]ethyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Traditional Name: N-[2-[4-(2-methylthiazol-4-yl)phenyl]ethyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide Formula: C21H22N2O4S2 MolecularWeight: 430.54038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C2=CC=C(C=C2)CCNS(=O)(=O)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CC1=NC(=CS1)C2=CC=C(C=C2)CCNS(=O)(=O)C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C21H22N2O4S2/c1-15-23-19(14-28-15)17-5-3-16(4-6-17)9-10-22-29(24,25)18-7-8-20-21(13-18)27-12-2-11-26-20/h3-8,13-14,22H,2,9-12H2,1H3