5-[(4-cyclopropyl-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-3-(4-propan-2-ylphenyl)-1,2,4-oxadiazole

Systemtic Name: 5-[(4-cyclopropyl-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-3-(4-propan-2-ylphenyl)-1,2,4-oxadiazole Openeye Name: 5-[(4-cyclopropyl-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-3-(4-isopropylphenyl)-1,2,4-oxadiazole CAS Name: 5-[[[4-cyclopropyl-5-(1-pyrrolidinyl)-1,2,4-triazol-3-yl]thio]methyl]-3-(4-propan-2-ylphenyl)-1,2,4-oxadiazole IUPAC Name: 5-[(4-cyclopropyl-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-3-(4-propan-2-ylphenyl)-1,2,4-oxadiazole Traditional Name: 5-[[(4-cyclopropyl-5-pyrrolidino-1,2,4-triazol-3-yl)thio]methyl]-3-p-cumenyl-1,2,4-oxadiazole Formula: C21H26N6OS MolecularWeight: 410.53574

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=NOC(=N2)CSC3=NN=C(N3C4CC4)N5CCCC5

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=NOC(=N2)CSC3=NN=C(N3C4CC4)N5CCCC5

InChI

InChI=1S/C21H26N6OS/c1-14(2)15-5-7-16(8-6-15)19-22-18(28-25-19)13-29-21-24-23-20(26-11-3-4-12-26)27(21)17-9-10-17/h5-8,14,17H,3-4,9-13H2,1-2H3