N-[(4-morpholin-4-ylsulfonylphenyl)methyl]-2H-benzotriazole-5-carboxamide

Systemtic Name: N-[(4-morpholin-4-ylsulfonylphenyl)methyl]-2H-benzotriazole-5-carboxamide Openeye Name: N-[(4-morpholinosulfonylphenyl)methyl]-2H-benzotriazole-5-carboxamide CAS Name: N-[[4-(4-morpholinylsulfonyl)phenyl]methyl]-2H-benzotriazole-5-carboxamide IUPAC Name: N-[(4-morpholin-4-ylsulfonylphenyl)methyl]-2H-benzotriazole-5-carboxamide Traditional Name: N-(4-morpholinosulfonylbenzyl)-2H-benzotriazole-5-carboxamide Formula: C18H19N5O4S MolecularWeight: 401.43956

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)CNC(=O)C3=CC4=NNN=C4C=C3

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)CNC(=O)C3=CC4=NNN=C4C=C3

InChI

InChI=1S/C18H19N5O4S/c24-18(14-3-6-16-17(11-14)21-22-20-16)19-12-13-1-4-15(5-2-13)28(25,26)23-7-9-27-10-8-23/h1-6,11H,7-10,12H2,(H,19,24)(H,20,21,22)