4-(benzotriazol-1-ylmethyl)-N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)benzamide

Systemtic Name: 4-(benzotriazol-1-ylmethyl)-N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)benzamide Openeye Name: 4-(benzotriazol-1-ylmethyl)-N-(4-methyl-3-morpholinosulfonyl-phenyl)benzamide CAS Name: 4-(1-benzotriazolylmethyl)-N-[4-methyl-3-(4-morpholinylsulfonyl)phenyl]benzamide IUPAC Name: 4-(benzotriazol-1-ylmethyl)-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)benzamide Traditional Name: 4-(benzotriazol-1-ylmethyl)-N-(4-methyl-3-morpholinosulfonyl-phenyl)benzamide Formula: C25H25N5O4S MolecularWeight: 491.5621

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)CN3C4=CC=CC=C4N=N3)S(=O)(=O)N5CCOCC5

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)CN3C4=CC=CC=C4N=N3)S(=O)(=O)N5CCOCC5

InChI

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