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

Systemtic Name: N-[4-[2-[(5-cyclopropyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]phenyl]benzamide Openeye Name: N-[4-[2-[(5-cyclopropyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]phenyl]benzamide CAS Name: N-[4-[2-[(5-cyclopropyl-4-methyl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]phenyl]benzamide IUPAC Name: N-[4-[2-[(5-cyclopropyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]phenyl]benzamide Traditional Name: N-[4-[2-[(5-cyclopropyl-4-methyl-1,2,4-triazol-3-yl)thio]acetyl]phenyl]benzamide Formula: C21H20N4O2S MolecularWeight: 392.4741

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3)C4CC4

Isomeric SMILES

CN1C(=NN=C1SCC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3)C4CC4

InChI

InChI=1S/C21H20N4O2S/c1-25-19(15-7-8-15)23-24-21(25)28-13-18(26)14-9-11-17(12-10-14)22-20(27)16-5-3-2-4-6-16/h2-6,9-12,15H,7-8,13H2,1H3,(H,22,27)