6-[5-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-1,2-dihydro-1,2,4-triazol-3-ylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[5-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-1,2-dihydro-1,2,4-triazol-3-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: 6-[5-[2-oxo-2-(1-piperidyl)ethyl]sulfanyl-1,2-dihydro-1,2,4-triazol-3-ylidene]cyclohexa-2,4-dien-1-one CAS Name: 6-[5-[[2-oxo-2-(1-piperidinyl)ethyl]thio]-1,2-dihydro-1,2,4-triazol-3-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 6-[5-(2-oxo-2-piperidin-1-ylethyl)sulfanyl-1,2-dihydro-1,2,4-triazol-3-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: 6-[5-[(2-keto-2-piperidino-ethyl)thio]-1,2-dihydro-1,2,4-triazol-3-ylidene]cyclohexa-2,4-dien-1-one Formula: C15H18N4O2S MolecularWeight: 318.39402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CSC2=NC(=C3C=CC=CC3=O)NN2

Isomeric SMILES

C1CCN(CC1)C(=O)CSC2=NC(=C3C=CC=CC3=O)NN2

InChI

InChI=1S/C15H18N4O2S/c20-12-7-3-2-6-11(12)14-16-15(18-17-14)22-10-13(21)19-8-4-1-5-9-19/h2-3,6-7,17H,1,4-5,8-10H2,(H,16,18)