N-(3,4-dimethylphenyl)-2-(6-morpholin-4-ylsulfonylbenzotriazol-1-yl)oxy-ethanamide

Systemtic Name: N-(3,4-dimethylphenyl)-2-(6-morpholin-4-ylsulfonylbenzotriazol-1-yl)oxy-ethanamide Openeye Name: N-(3,4-dimethylphenyl)-2-(6-morpholinosulfonylbenzotriazol-1-yl)oxy-acetamide CAS Name: N-(3,4-dimethylphenyl)-2-[[6-(4-morpholinylsulfonyl)-1-benzotriazolyl]oxy]acetamide IUPAC Name: N-(3,4-dimethylphenyl)-2-(6-morpholin-4-ylsulfonylbenzotriazol-1-yl)oxyacetamide Traditional Name: N-(3,4-dimethylphenyl)-2-(6-morpholinosulfonylbenzotriazol-1-yl)oxy-acetamide Formula: C20H23N5O5S MolecularWeight: 445.49212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CON2C3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)N=N2)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CON2C3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)N=N2)C

InChI

InChI=1S/C20H23N5O5S/c1-14-3-4-16(11-15(14)2)21-20(26)13-30-25-19-12-17(5-6-18(19)22-23-25)31(27,28)24-7-9-29-10-8-24/h3-6,11-12H,7-10,13H2,1-2H3,(H,21,26)