4-cyclopropyl-3-methyl-5-[(1R)-1-(3-nitrophenyl)ethyl]sulfanyl-1,2,4-triazole

Systemtic Name: 4-cyclopropyl-3-methyl-5-[(1R)-1-(3-nitrophenyl)ethyl]sulfanyl-1,2,4-triazole Openeye Name: 4-cyclopropyl-3-methyl-5-[(1R)-1-(3-nitrophenyl)ethyl]sulfanyl-1,2,4-triazole CAS Name: 4-cyclopropyl-3-methyl-5-[[(1R)-1-(3-nitrophenyl)ethyl]thio]-1,2,4-triazole IUPAC Name: 4-cyclopropyl-3-methyl-5-[(1R)-1-(3-nitrophenyl)ethyl]sulfanyl-1,2,4-triazole Traditional Name: 4-cyclopropyl-3-methyl-5-[[(1R)-1-(3-nitrophenyl)ethyl]thio]-1,2,4-triazole Formula: C14H16N4O2S MolecularWeight: 304.36744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2CC2)SC(C)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=NN=C(N1C2CC2)S[C@H](C)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H16N4O2S/c1-9(11-4-3-5-13(8-11)18(19)20)21-14-16-15-10(2)17(14)12-6-7-12/h3-5,8-9,12H,6-7H2,1-2H3/t9-/m1/s1