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

Systemtic Name: 4-cyclopropyl-3-[(2-phenoxyphenyl)methylsulfanyl]-5-thiophen-2-yl-1,2,4-triazole Openeye Name: 4-cyclopropyl-3-[(2-phenoxyphenyl)methylsulfanyl]-5-(2-thienyl)-1,2,4-triazole CAS Name: 4-cyclopropyl-3-[(2-phenoxyphenyl)methylthio]-5-thiophen-2-yl-1,2,4-triazole IUPAC Name: 4-cyclopropyl-3-[(2-phenoxyphenyl)methylsulfanyl]-5-thiophen-2-yl-1,2,4-triazole Traditional Name: 4-cyclopropyl-3-[(2-phenoxybenzyl)thio]-5-(2-thienyl)-1,2,4-triazole Formula: C22H19N3OS2 MolecularWeight: 405.53576

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=C2SCC3=CC=CC=C3OC4=CC=CC=C4)C5=CC=CS5

Isomeric SMILES

C1CC1N2C(=NN=C2SCC3=CC=CC=C3OC4=CC=CC=C4)C5=CC=CS5

InChI

InChI=1S/C22H19N3OS2/c1-2-8-18(9-3-1)26-19-10-5-4-7-16(19)15-28-22-24-23-21(20-11-6-14-27-20)25(22)17-12-13-17/h1-11,14,17H,12-13,15H2