4-cyclopropyl-3-[1-(3-nitrophenyl)ethylsulfanyl]-5-propan-2-yl-1,2,4-triazole

Systemtic Name: 4-cyclopropyl-3-[1-(3-nitrophenyl)ethylsulfanyl]-5-propan-2-yl-1,2,4-triazole Openeye Name: 4-cyclopropyl-3-isopropyl-5-[1-(3-nitrophenyl)ethylsulfanyl]-1,2,4-triazole CAS Name: 4-cyclopropyl-3-[1-(3-nitrophenyl)ethylthio]-5-propan-2-yl-1,2,4-triazole IUPAC Name: 4-cyclopropyl-3-[1-(3-nitrophenyl)ethylsulfanyl]-5-propan-2-yl-1,2,4-triazole Traditional Name: 4-cyclopropyl-3-isopropyl-5-[1-(3-nitrophenyl)ethylthio]-1,2,4-triazole Formula: C16H20N4O2S MolecularWeight: 332.4206

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C(N1C2CC2)SC(C)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=NN=C(N1C2CC2)SC(C)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H20N4O2S/c1-10(2)15-17-18-16(19(15)13-7-8-13)23-11(3)12-5-4-6-14(9-12)20(21)22/h4-6,9-11,13H,7-8H2,1-3H3