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

Systemtic Name: 3-[(4-chlorophenyl)methylsulfanyl]-4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazole Openeye Name: 3-[(4-chlorophenyl)methylsulfanyl]-4-cyclopropyl-5-(2-thienylmethyl)-1,2,4-triazole CAS Name: 3-[(4-chlorophenyl)methylthio]-4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazole IUPAC Name: 3-[(4-chlorophenyl)methylsulfanyl]-4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazole Traditional Name: 3-[(4-chlorobenzyl)thio]-4-cyclopropyl-5-(2-thenyl)-1,2,4-triazole Formula: C17H16ClN3S2 MolecularWeight: 361.91204

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=C2SCC3=CC=C(C=C3)Cl)CC4=CC=CS4

Isomeric SMILES

C1CC1N2C(=NN=C2SCC3=CC=C(C=C3)Cl)CC4=CC=CS4

InChI

InChI=1S/C17H16ClN3S2/c18-13-5-3-12(4-6-13)11-23-17-20-19-16(21(17)14-7-8-14)10-15-2-1-9-22-15/h1-6,9,14H,7-8,10-11H2