1-[(2,5-dimethylphenyl)methoxy]-6-piperidin-1-ylsulfonyl-benzotriazole

Systemtic Name: 1-[(2,5-dimethylphenyl)methoxy]-6-piperidin-1-ylsulfonyl-benzotriazole Openeye Name: 1-[(2,5-dimethylphenyl)methoxy]-6-(1-piperidylsulfonyl)benzotriazole CAS Name: 1-[(2,5-dimethylphenyl)methoxy]-6-(1-piperidinylsulfonyl)benzotriazole IUPAC Name: 1-[(2,5-dimethylphenyl)methoxy]-6-piperidin-1-ylsulfonylbenzotriazole Traditional Name: 1-(2,5-dimethylbenzyl)oxy-6-piperidinosulfonyl-benzotriazole Formula: C20H24N4O3S MolecularWeight: 400.49456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CON2C3=C(C=CC(=C3)S(=O)(=O)N4CCCCC4)N=N2

Isomeric SMILES

CC1=CC(=C(C=C1)C)CON2C3=C(C=CC(=C3)S(=O)(=O)N4CCCCC4)N=N2

InChI

InChI=1S/C20H24N4O3S/c1-15-6-7-16(2)17(12-15)14-27-24-20-13-18(8-9-19(20)21-22-24)28(25,26)23-10-4-3-5-11-23/h6-9,12-13H,3-5,10-11,14H2,1-2H3