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

Systemtic Name: 3-methyl-4-phenyl-5-(2-pyrrolidin-1-ylethylsulfanyl)-1,2,4-triazole Openeye Name: 3-methyl-4-phenyl-5-(2-pyrrolidin-1-ylethylsulfanyl)-1,2,4-triazole CAS Name: 3-methyl-4-phenyl-5-[2-(1-pyrrolidinyl)ethylthio]-1,2,4-triazole IUPAC Name: 3-methyl-4-phenyl-5-(2-pyrrolidin-1-ylethylsulfanyl)-1,2,4-triazole Traditional Name: 3-methyl-4-phenyl-5-(2-pyrrolidinoethylthio)-1,2,4-triazole Formula: C15H20N4S MolecularWeight: 288.4111

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2=CC=CC=C2)SCCN3CCCC3

Isomeric SMILES

CC1=NN=C(N1C2=CC=CC=C2)SCCN3CCCC3

InChI

InChI=1S/C15H20N4S/c1-13-16-17-15(19(13)14-7-3-2-4-8-14)20-12-11-18-9-5-6-10-18/h2-4,7-8H,5-6,9-12H2,1H3