benzotriazol-1-yl-(4-chloranyl-3-piperidin-1-ylsulfonyl-phenyl)methanone

Systemtic Name: benzotriazol-1-yl-(4-chloranyl-3-piperidin-1-ylsulfonyl-phenyl)methanone Openeye Name: benzotriazol-1-yl-[4-chloro-3-(1-piperidylsulfonyl)phenyl]methanone CAS Name: 1-benzotriazolyl-[4-chloro-3-(1-piperidinylsulfonyl)phenyl]methanone IUPAC Name: benzotriazol-1-yl-(4-chloro-3-piperidin-1-ylsulfonylphenyl)methanone Traditional Name: benzotriazol-1-yl-(4-chloro-3-piperidinosulfonyl-phenyl)methanone Formula: C18H17ClN4O3S MolecularWeight: 404.87058

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)N3C4=CC=CC=C4N=N3)Cl

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)N3C4=CC=CC=C4N=N3)Cl

InChI

InChI=1S/C18H17ClN4O3S/c19-14-9-8-13(12-17(14)27(25,26)22-10-4-1-5-11-22)18(24)23-16-7-3-2-6-15(16)20-21-23/h2-3,6-9,12H,1,4-5,10-11H2