4-cyclopropyl-3-[(2-phenoxyphenyl)methylsulfanyl]-5-(thiophen-2-ylmethyl)-1,2,4-triazole

Systemtic Name: 4-cyclopropyl-3-[(2-phenoxyphenyl)methylsulfanyl]-5-(thiophen-2-ylmethyl)-1,2,4-triazole Openeye Name: 4-cyclopropyl-3-[(2-phenoxyphenyl)methylsulfanyl]-5-(2-thienylmethyl)-1,2,4-triazole CAS Name: 4-cyclopropyl-3-[(2-phenoxyphenyl)methylthio]-5-(thiophen-2-ylmethyl)-1,2,4-triazole IUPAC Name: 4-cyclopropyl-3-[(2-phenoxyphenyl)methylsulfanyl]-5-(thiophen-2-ylmethyl)-1,2,4-triazole Traditional Name: 4-cyclopropyl-3-[(2-phenoxybenzyl)thio]-5-(2-thenyl)-1,2,4-triazole Formula: C23H21N3OS2 MolecularWeight: 419.56234

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=C2SCC3=CC=CC=C3OC4=CC=CC=C4)CC5=CC=CS5

Isomeric SMILES

C1CC1N2C(=NN=C2SCC3=CC=CC=C3OC4=CC=CC=C4)CC5=CC=CS5

InChI

InChI=1S/C23H21N3OS2/c1-2-8-19(9-3-1)27-21-11-5-4-7-17(21)16-29-23-25-24-22(26(23)18-12-13-18)15-20-10-6-14-28-20/h1-11,14,18H,12-13,15-16H2