4-(oxolan-2-ylmethyl)-3-[(2-phenylphenyl)methylsulfanyl]-5-pyrrolidin-2-yl-1,2,4-triazole

Systemtic Name: 4-(oxolan-2-ylmethyl)-3-[(2-phenylphenyl)methylsulfanyl]-5-pyrrolidin-2-yl-1,2,4-triazole Openeye Name: 3-[(2-phenylphenyl)methylsulfanyl]-5-pyrrolidin-2-yl-4-(tetrahydrofuran-2-ylmethyl)-1,2,4-triazole CAS Name: 4-(2-oxolanylmethyl)-3-[(2-phenylphenyl)methylthio]-5-(2-pyrrolidinyl)-1,2,4-triazole IUPAC Name: 4-(oxolan-2-ylmethyl)-3-[(2-phenylphenyl)methylsulfanyl]-5-pyrrolidin-2-yl-1,2,4-triazole Traditional Name: 3-[(2-phenylbenzyl)thio]-5-pyrrolidin-2-yl-4-(tetrahydrofurfuryl)-1,2,4-triazole Formula: C24H28N4OS MolecularWeight: 420.57032

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC1)C2=NN=C(N2CC3CCCO3)SCC4=CC=CC=C4C5=CC=CC=C5

Isomeric SMILES

C1CC(NC1)C2=NN=C(N2CC3CCCO3)SCC4=CC=CC=C4C5=CC=CC=C5

InChI

InChI=1S/C24H28N4OS/c1-2-8-18(9-3-1)21-12-5-4-10-19(21)17-30-24-27-26-23(22-13-6-14-25-22)28(24)16-20-11-7-15-29-20/h1-5,8-10,12,20,22,25H,6-7,11,13-17H2