3-[(7-chloranyl-1,3-benzodioxol-5-yl)methylsulfanyl]-4-cyclopropyl-5-propan-2-yl-1,2,4-triazole

Systemtic Name: 3-[(7-chloranyl-1,3-benzodioxol-5-yl)methylsulfanyl]-4-cyclopropyl-5-propan-2-yl-1,2,4-triazole Openeye Name: 3-[(7-chloro-1,3-benzodioxol-5-yl)methylsulfanyl]-4-cyclopropyl-5-isopropyl-1,2,4-triazole CAS Name: 3-[(7-chloro-1,3-benzodioxol-5-yl)methylthio]-4-cyclopropyl-5-propan-2-yl-1,2,4-triazole IUPAC Name: 3-[(7-chloro-1,3-benzodioxol-5-yl)methylsulfanyl]-4-cyclopropyl-5-propan-2-yl-1,2,4-triazole Traditional Name: 3-[(7-chloro-1,3-benzodioxol-5-yl)methylthio]-4-cyclopropyl-5-isopropyl-1,2,4-triazole Formula: C16H18ClN3O2S MolecularWeight: 351.85102

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C(N1C2CC2)SCC3=CC4=C(C(=C3)Cl)OCO4

Isomeric SMILES

CC(C)C1=NN=C(N1C2CC2)SCC3=CC4=C(C(=C3)Cl)OCO4

InChI

InChI=1S/C16H18ClN3O2S/c1-9(2)15-18-19-16(20(15)11-3-4-11)23-7-10-5-12(17)14-13(6-10)21-8-22-14/h5-6,9,11H,3-4,7-8H2,1-2H3