N-[2-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)-4-methyl-phenyl]-4-methylsulfonyl-benzamide

Systemtic Name: N-[2-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)-4-methyl-phenyl]-4-methylsulfonyl-benzamide Openeye Name: N-[2-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)-4-methyl-phenyl]-4-methylsulfonyl-benzamide CAS Name: N-[2-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)-4-methylphenyl]-4-methylsulfonylbenzamide IUPAC Name: N-[2-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)-4-methylphenyl]-4-methylsulfonylbenzamide Traditional Name: N-[2-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)-4-methyl-phenyl]-4-mesyl-benzamide Formula: C20H20N4O3S MolecularWeight: 396.4628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)C)C3=NNC(=N3)C4CC4

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)C)C3=NNC(=N3)C4CC4

InChI

InChI=1S/C20H20N4O3S/c1-12-3-10-17(16(11-12)19-22-18(23-24-19)13-4-5-13)21-20(25)14-6-8-15(9-7-14)28(2,26)27/h3,6-11,13H,4-5H2,1-2H3,(H,21,25)(H,22,23,24)