1-(azepan-1-ylsulfonyl)benzotriazole

Systemtic Name: 1-(azepan-1-ylsulfonyl)benzotriazole Openeye Name: 1-(azepan-1-ylsulfonyl)benzotriazole CAS Name: 1-(1-azepanylsulfonyl)benzotriazole IUPAC Name: 1-(azepan-1-ylsulfonyl)benzotriazole Traditional Name: 1-(azepan-1-ylsulfonyl)benzotriazole Formula: C12H16N4O2S MolecularWeight: 280.34604

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)N2C3=CC=CC=C3N=N2

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)N2C3=CC=CC=C3N=N2

InChI

InChI=1S/C12H16N4O2S/c17-19(18,15-9-5-1-2-6-10-15)16-12-8-4-3-7-11(12)13-14-16/h3-4,7-8H,1-2,5-6,9-10H2