4-(benzotriazol-1-ylmethyl)-N-(2-methyl-5-morpholin-4-ylsulfonyl-phenyl)benzamide

Systemtic Name: 4-(benzotriazol-1-ylmethyl)-N-(2-methyl-5-morpholin-4-ylsulfonyl-phenyl)benzamide Openeye Name: 4-(benzotriazol-1-ylmethyl)-N-(2-methyl-5-morpholinosulfonyl-phenyl)benzamide CAS Name: 4-(1-benzotriazolylmethyl)-N-[2-methyl-5-(4-morpholinylsulfonyl)phenyl]benzamide IUPAC Name: 4-(benzotriazol-1-ylmethyl)-N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)benzamide Traditional Name: 4-(benzotriazol-1-ylmethyl)-N-(2-methyl-5-morpholinosulfonyl-phenyl)benzamide Formula: C25H25N5O4S MolecularWeight: 491.5621

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)C3=CC=C(C=C3)CN4C5=CC=CC=C5N=N4

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)C3=CC=C(C=C3)CN4C5=CC=CC=C5N=N4

InChI

InChI=1S/C25H25N5O4S/c1-18-6-11-21(35(32,33)29-12-14-34-15-13-29)16-23(18)26-25(31)20-9-7-19(8-10-20)17-30-24-5-3-2-4-22(24)27-28-30/h2-11,16H,12-15,17H2,1H3,(H,26,31)