3-(2-methylpropylsulfanyl)-4-phenethyl-5-(thiophen-2-ylmethyl)-1,2,4-triazole

Systemtic Name: 3-(2-methylpropylsulfanyl)-4-phenethyl-5-(thiophen-2-ylmethyl)-1,2,4-triazole Openeye Name: 3-isobutylsulfanyl-4-phenethyl-5-(2-thienylmethyl)-1,2,4-triazole CAS Name: 3-(2-methylpropylthio)-4-phenethyl-5-(thiophen-2-ylmethyl)-1,2,4-triazole IUPAC Name: 3-(2-methylpropylsulfanyl)-4-phenethyl-5-(thiophen-2-ylmethyl)-1,2,4-triazole Traditional Name: 3-(isobutylthio)-4-phenethyl-5-(2-thenyl)-1,2,4-triazole Formula: C19H23N3S2 MolecularWeight: 357.53602

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CSC1=NN=C(N1CCC2=CC=CC=C2)CC3=CC=CS3

Isomeric SMILES

CC(C)CSC1=NN=C(N1CCC2=CC=CC=C2)CC3=CC=CS3

InChI

InChI=1S/C19H23N3S2/c1-15(2)14-24-19-21-20-18(13-17-9-6-12-23-17)22(19)11-10-16-7-4-3-5-8-16/h3-9,12,15H,10-11,13-14H2,1-2H3