5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-(4-morpholin-4-ylsulfonylphenyl)-6H-1,3,4-thiadiazin-2-amine

Systemtic Name: 5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-(4-morpholin-4-ylsulfonylphenyl)-6H-1,3,4-thiadiazin-2-amine Openeye Name: 5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-(4-morpholinosulfonylphenyl)-6H-1,3,4-thiadiazin-2-amine CAS Name: 5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-[4-(4-morpholinylsulfonyl)phenyl]-6H-1,3,4-thiadiazin-2-amine IUPAC Name: 5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-(4-morpholin-4-ylsulfonylphenyl)-6H-1,3,4-thiadiazin-2-amine Traditional Name: [5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6H-1,3,4-thiadiazin-2-yl]-(4-morpholinosulfonylphenyl)amine Formula: C22H24N4O5S2 MolecularWeight: 488.57976

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)C3=NN=C(SC3)NC4=CC=C(C=C4)S(=O)(=O)N5CCOCC5)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)C3=NN=C(SC3)NC4=CC=C(C=C4)S(=O)(=O)N5CCOCC5)OC1

InChI

InChI=1S/C22H24N4O5S2/c27-33(28,26-8-12-29-13-9-26)18-5-3-17(4-6-18)23-22-25-24-19(15-32-22)16-2-7-20-21(14-16)31-11-1-10-30-20/h2-7,14H,1,8-13,15H2,(H,23,25)