4-ethyl-3-[(1-methylpyrrol-2-yl)methyl]-5-(naphthalen-1-ylmethylsulfanyl)-1,2,4-triazole

Systemtic Name: 4-ethyl-3-[(1-methylpyrrol-2-yl)methyl]-5-(naphthalen-1-ylmethylsulfanyl)-1,2,4-triazole Openeye Name: 4-ethyl-3-[(1-methylpyrrol-2-yl)methyl]-5-(1-naphthylmethylsulfanyl)-1,2,4-triazole CAS Name: 4-ethyl-3-[(1-methyl-2-pyrrolyl)methyl]-5-(1-naphthalenylmethylthio)-1,2,4-triazole IUPAC Name: 4-ethyl-3-[(1-methylpyrrol-2-yl)methyl]-5-(naphthalen-1-ylmethylsulfanyl)-1,2,4-triazole Traditional Name: 4-ethyl-3-[(1-methylpyrrol-2-yl)methyl]-5-(1-naphthylmethylthio)-1,2,4-triazole Formula: C21H22N4S MolecularWeight: 362.49118

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=CC=CC3=CC=CC=C32)CC4=CC=CN4C

Isomeric SMILES

CCN1C(=NN=C1SCC2=CC=CC3=CC=CC=C32)CC4=CC=CN4C

InChI

InChI=1S/C21H22N4S/c1-3-25-20(14-18-11-7-13-24(18)2)22-23-21(25)26-15-17-10-6-9-16-8-4-5-12-19(16)17/h4-13H,3,14-15H2,1-2H3