3-(2-methoxyphenyl)-4-methyl-5-(2-pyrrolidin-1-ylethylsulfanyl)-1,2,4-triazole

Systemtic Name: 3-(2-methoxyphenyl)-4-methyl-5-(2-pyrrolidin-1-ylethylsulfanyl)-1,2,4-triazole Openeye Name: 3-(2-methoxyphenyl)-4-methyl-5-(2-pyrrolidin-1-ylethylsulfanyl)-1,2,4-triazole CAS Name: 3-(2-methoxyphenyl)-4-methyl-5-[2-(1-pyrrolidinyl)ethylthio]-1,2,4-triazole IUPAC Name: 3-(2-methoxyphenyl)-4-methyl-5-(2-pyrrolidin-1-ylethylsulfanyl)-1,2,4-triazole Traditional Name: 3-(2-methoxyphenyl)-4-methyl-5-(2-pyrrolidinoethylthio)-1,2,4-triazole Formula: C16H22N4OS MolecularWeight: 318.43708

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCCN2CCCC2)C3=CC=CC=C3OC

Isomeric SMILES

CN1C(=NN=C1SCCN2CCCC2)C3=CC=CC=C3OC

InChI

InChI=1S/C16H22N4OS/c1-19-15(13-7-3-4-8-14(13)21-2)17-18-16(19)22-12-11-20-9-5-6-10-20/h3-4,7-8H,5-6,9-12H2,1-2H3