N-[4-methoxy-3-(methylsulfonylamino)phenyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide

Systemtic Name: N-[4-methoxy-3-(methylsulfonylamino)phenyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide Openeye Name: N-[3-(methanesulfonamido)-4-methoxy-phenyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide CAS Name: N-[3-(methanesulfonamido)-4-methoxyphenyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide IUPAC Name: N-[3-(methanesulfonamido)-4-methoxyphenyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide Traditional Name: N-[3-(methanesulfonamido)-4-methoxy-phenyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide Formula: C18H19N5O4S MolecularWeight: 401.43956

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)CN3C=NC=N3)NS(=O)(=O)C

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)CN3C=NC=N3)NS(=O)(=O)C

InChI

InChI=1S/C18H19N5O4S/c1-27-17-8-7-15(9-16(17)22-28(2,25)26)21-18(24)14-5-3-13(4-6-14)10-23-12-19-11-20-23/h3-9,11-12,22H,10H2,1-2H3,(H,21,24)