N-(2-methoxy-5-morpholin-4-ylsulfonyl-phenyl)-1-(phenylmethyl)-1,2,3-triazole-4-carboxamide

Systemtic Name: N-(2-methoxy-5-morpholin-4-ylsulfonyl-phenyl)-1-(phenylmethyl)-1,2,3-triazole-4-carboxamide Openeye Name: 1-benzyl-N-(2-methoxy-5-morpholinosulfonyl-phenyl)triazole-4-carboxamide CAS Name: N-[2-methoxy-5-(4-morpholinylsulfonyl)phenyl]-1-(phenylmethyl)-4-triazolecarboxamide IUPAC Name: 1-benzyl-N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)triazole-4-carboxamide Traditional Name: 1-benzyl-N-(2-methoxy-5-morpholinosulfonyl-phenyl)triazole-4-carboxamide Formula: C21H23N5O5S MolecularWeight: 457.50282

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)C3=CN(N=N3)CC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)C3=CN(N=N3)CC4=CC=CC=C4

InChI

InChI=1S/C21H23N5O5S/c1-30-20-8-7-17(32(28,29)26-9-11-31-12-10-26)13-18(20)22-21(27)19-15-25(24-23-19)14-16-5-3-2-4-6-16/h2-8,13,15H,9-12,14H2,1H3,(H,22,27)