N-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]-1-ethyl-benzotriazole-5-carboxamide

Systemtic Name: N-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]-1-ethyl-benzotriazole-5-carboxamide Openeye Name: N-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]-1-ethyl-benzotriazole-5-carboxamide CAS Name: N-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]-1-ethyl-5-benzotriazolecarboxamide IUPAC Name: N-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]-1-ethylbenzotriazole-5-carboxamide Traditional Name: N-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]-1-ethyl-benzotriazole-5-carboxamide Formula: C24H23N5O5S MolecularWeight: 493.53492

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)NS(=O)(=O)C4=CC5=C(C=C4)OCCCO5)N=N1

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)NS(=O)(=O)C4=CC5=C(C=C4)OCCCO5)N=N1

InChI

InChI=1S/C24H23N5O5S/c1-2-29-21-10-4-16(14-20(21)26-28-29)24(30)25-17-5-7-18(8-6-17)27-35(31,32)19-9-11-22-23(15-19)34-13-3-12-33-22/h4-11,14-15,27H,2-3,12-13H2,1H3,(H,25,30)