6-[4-methyl-3-(2-pyrrolidin-1-ylethylsulfanyl)-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[4-methyl-3-(2-pyrrolidin-1-ylethylsulfanyl)-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: 6-[4-methyl-3-(2-pyrrolidin-1-ylethylsulfanyl)-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,4-dien-1-one CAS Name: 6-[4-methyl-3-[2-(1-pyrrolidinyl)ethylthio]-1H-1,2,4-triazol-5-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 6-[4-methyl-3-(2-pyrrolidin-1-ylethylsulfanyl)-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: 6-[4-methyl-3-(2-pyrrolidinoethylthio)-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,4-dien-1-one Formula: C15H20N4OS MolecularWeight: 304.4105

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C2C=CC=CC2=O)NN=C1SCCN3CCCC3

Isomeric SMILES

CN1C(=C2C=CC=CC2=O)NN=C1SCCN3CCCC3

InChI

InChI=1S/C15H20N4OS/c1-18-14(12-6-2-3-7-13(12)20)16-17-15(18)21-11-10-19-8-4-5-9-19/h2-3,6-7,16H,4-5,8-11H2,1H3