2-[(4-cyclopropyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-phenoxyphenyl)ethanone

Systemtic Name: 2-[(4-cyclopropyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-phenoxyphenyl)ethanone Openeye Name: 2-[(4-cyclopropyl-5-isopropyl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-phenoxyphenyl)ethanone CAS Name: 2-[(4-cyclopropyl-5-propan-2-yl-1,2,4-triazol-3-yl)thio]-1-(4-phenoxyphenyl)ethanone IUPAC Name: 2-[(4-cyclopropyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-phenoxyphenyl)ethanone Traditional Name: 2-[(4-cyclopropyl-5-isopropyl-1,2,4-triazol-3-yl)thio]-1-(4-phenoxyphenyl)ethanone Formula: C22H23N3O2S MolecularWeight: 393.50192

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C(N1C2CC2)SCC(=O)C3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

CC(C)C1=NN=C(N1C2CC2)SCC(=O)C3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C22H23N3O2S/c1-15(2)21-23-24-22(25(21)17-10-11-17)28-14-20(26)16-8-12-19(13-9-16)27-18-6-4-3-5-7-18/h3-9,12-13,15,17H,10-11,14H2,1-2H3