3-[(4-propan-2-ylphenyl)methylsulfanyl]-5-thiophen-2-yl-1H-1,2,4-triazole

Systemtic Name: 3-[(4-propan-2-ylphenyl)methylsulfanyl]-5-thiophen-2-yl-1H-1,2,4-triazole Openeye Name: 3-[(4-isopropylphenyl)methylsulfanyl]-5-(2-thienyl)-1H-1,2,4-triazole CAS Name: 3-[(4-propan-2-ylphenyl)methylthio]-5-thiophen-2-yl-1H-1,2,4-triazole IUPAC Name: 3-[(4-propan-2-ylphenyl)methylsulfanyl]-5-thiophen-2-yl-1H-1,2,4-triazole Traditional Name: 3-[(4-isopropylbenzyl)thio]-5-(2-thienyl)-1H-1,2,4-triazole Formula: C16H17N3S2 MolecularWeight: 315.45628

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CSC2=NNC(=N2)C3=CC=CS3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CSC2=NNC(=N2)C3=CC=CS3

InChI

InChI=1S/C16H17N3S2/c1-11(2)13-7-5-12(6-8-13)10-21-16-17-15(18-19-16)14-4-3-9-20-14/h3-9,11H,10H2,1-2H3,(H,17,18,19)