3-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]-4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazole

Systemtic Name: 3-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]-4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazole Openeye Name: 3-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]-4-cyclopropyl-5-(2-thienylmethyl)-1,2,4-triazole CAS Name: 3-[(4-tert-butyl-2,6-dimethylphenyl)methylthio]-4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazole IUPAC Name: 3-[(4-tert-butyl-2,6-dimethylphenyl)methylsulfanyl]-4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazole Traditional Name: 3-[(4-tert-butyl-2,6-dimethyl-benzyl)thio]-4-cyclopropyl-5-(2-thenyl)-1,2,4-triazole Formula: C23H29N3S2 MolecularWeight: 411.62646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1CSC2=NN=C(N2C3CC3)CC4=CC=CS4)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1CSC2=NN=C(N2C3CC3)CC4=CC=CS4)C)C(C)(C)C

InChI

InChI=1S/C23H29N3S2/c1-15-11-17(23(3,4)5)12-16(2)20(15)14-28-22-25-24-21(26(22)18-8-9-18)13-19-7-6-10-27-19/h6-7,10-12,18H,8-9,13-14H2,1-5H3