4-cyclopropyl-3-[(1,3-diphenylpyrazol-4-yl)methylsulfanyl]-5-pyrrolidin-1-yl-1,2,4-triazole

Systemtic Name: 4-cyclopropyl-3-[(1,3-diphenylpyrazol-4-yl)methylsulfanyl]-5-pyrrolidin-1-yl-1,2,4-triazole Openeye Name: 4-cyclopropyl-3-[(1,3-diphenylpyrazol-4-yl)methylsulfanyl]-5-pyrrolidin-1-yl-1,2,4-triazole CAS Name: 4-cyclopropyl-3-[(1,3-diphenyl-4-pyrazolyl)methylthio]-5-(1-pyrrolidinyl)-1,2,4-triazole IUPAC Name: 4-cyclopropyl-3-[(1,3-diphenylpyrazol-4-yl)methylsulfanyl]-5-pyrrolidin-1-yl-1,2,4-triazole Traditional Name: 4-cyclopropyl-3-[(1,3-diphenylpyrazol-4-yl)methylthio]-5-pyrrolidino-1,2,4-triazole Formula: C25H26N6S MolecularWeight: 442.57914

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NN=C(N2C3CC3)SCC4=CN(N=C4C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1CCN(C1)C2=NN=C(N2C3CC3)SCC4=CN(N=C4C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C25H26N6S/c1-3-9-19(10-4-1)23-20(17-30(28-23)21-11-5-2-6-12-21)18-32-25-27-26-24(29-15-7-8-16-29)31(25)22-13-14-22/h1-6,9-12,17,22H,7-8,13-16,18H2