4-cyclopropyl-3-[(2-methyl-3-nitro-phenyl)methylsulfanyl]-5-(thiophen-2-ylmethyl)-1,2,4-triazole

Systemtic Name: 4-cyclopropyl-3-[(2-methyl-3-nitro-phenyl)methylsulfanyl]-5-(thiophen-2-ylmethyl)-1,2,4-triazole Openeye Name: 4-cyclopropyl-3-[(2-methyl-3-nitro-phenyl)methylsulfanyl]-5-(2-thienylmethyl)-1,2,4-triazole CAS Name: 4-cyclopropyl-3-[(2-methyl-3-nitrophenyl)methylthio]-5-(thiophen-2-ylmethyl)-1,2,4-triazole IUPAC Name: 4-cyclopropyl-3-[(2-methyl-3-nitrophenyl)methylsulfanyl]-5-(thiophen-2-ylmethyl)-1,2,4-triazole Traditional Name: 4-cyclopropyl-3-[(2-methyl-3-nitro-benzyl)thio]-5-(2-thenyl)-1,2,4-triazole Formula: C18H18N4O2S2 MolecularWeight: 386.49112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])CSC2=NN=C(N2C3CC3)CC4=CC=CS4

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])CSC2=NN=C(N2C3CC3)CC4=CC=CS4

InChI

InChI=1S/C18H18N4O2S2/c1-12-13(4-2-6-16(12)22(23)24)11-26-18-20-19-17(21(18)14-7-8-14)10-15-5-3-9-25-15/h2-6,9,14H,7-8,10-11H2,1H3