4-cyclopropyl-3-[(2,5-dimethylphenyl)methylsulfanyl]-5-thiophen-2-yl-1,2,4-triazole

Systemtic Name: 4-cyclopropyl-3-[(2,5-dimethylphenyl)methylsulfanyl]-5-thiophen-2-yl-1,2,4-triazole Openeye Name: 4-cyclopropyl-3-[(2,5-dimethylphenyl)methylsulfanyl]-5-(2-thienyl)-1,2,4-triazole CAS Name: 4-cyclopropyl-3-[(2,5-dimethylphenyl)methylthio]-5-thiophen-2-yl-1,2,4-triazole IUPAC Name: 4-cyclopropyl-3-[(2,5-dimethylphenyl)methylsulfanyl]-5-thiophen-2-yl-1,2,4-triazole Traditional Name: 4-cyclopropyl-3-[(2,5-dimethylbenzyl)thio]-5-(2-thienyl)-1,2,4-triazole Formula: C18H19N3S2 MolecularWeight: 341.49356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CSC2=NN=C(N2C3CC3)C4=CC=CS4

Isomeric SMILES

CC1=CC(=C(C=C1)C)CSC2=NN=C(N2C3CC3)C4=CC=CS4

InChI

InChI=1S/C18H19N3S2/c1-12-5-6-13(2)14(10-12)11-23-18-20-19-17(16-4-3-9-22-16)21(18)15-7-8-15/h3-6,9-10,15H,7-8,11H2,1-2H3