N-[4-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]phenyl]-3-propan-2-yloxy-benzamide

Systemtic Name: N-[4-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]phenyl]-3-propan-2-yloxy-benzamide Openeye Name: 3-isopropoxy-N-[4-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]phenyl]benzamide CAS Name: N-[4-[[(5-methyl-1H-1,2,4-triazol-3-yl)thio]methyl]phenyl]-3-propan-2-yloxybenzamide IUPAC Name: N-[4-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]phenyl]-3-propan-2-yloxybenzamide Traditional Name: 3-isopropoxy-N-[4-[[(5-methyl-1H-1,2,4-triazol-3-yl)thio]methyl]phenyl]benzamide Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NN1)SCC2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)OC(C)C

Isomeric SMILES

CC1=NC(=NN1)SCC2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)OC(C)C

InChI

InChI=1S/C20H22N4O2S/c1-13(2)26-18-6-4-5-16(11-18)19(25)22-17-9-7-15(8-10-17)12-27-20-21-14(3)23-24-20/h4-11,13H,12H2,1-3H3,(H,22,25)(H,21,23,24)