3-cyclohexyl-5-(2-nitrophenyl)sulfanyl-4-prop-2-enyl-1,2,4-triazole

Systemtic Name: 3-cyclohexyl-5-(2-nitrophenyl)sulfanyl-4-prop-2-enyl-1,2,4-triazole Openeye Name: 4-allyl-3-cyclohexyl-5-(2-nitrophenyl)sulfanyl-1,2,4-triazole CAS Name: 3-cyclohexyl-5-[(2-nitrophenyl)thio]-4-prop-2-enyl-1,2,4-triazole IUPAC Name: 3-cyclohexyl-5-(2-nitrophenyl)sulfanyl-4-prop-2-enyl-1,2,4-triazole Traditional Name: 4-allyl-3-cyclohexyl-5-[(2-nitrophenyl)thio]-1,2,4-triazole Formula: C17H20N4O2S MolecularWeight: 344.4313

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SC2=CC=CC=C2[N+](=O)[O-])C3CCCCC3

Isomeric SMILES

C=CCN1C(=NN=C1SC2=CC=CC=C2[N+](=O)[O-])C3CCCCC3

InChI

InChI=1S/C17H20N4O2S/c1-2-12-20-16(13-8-4-3-5-9-13)18-19-17(20)24-15-11-7-6-10-14(15)21(22)23/h2,6-7,10-11,13H,1,3-5,8-9,12H2