4-[5-(1-azanyl-3-methylsulfanyl-propyl)-1,2,4-oxadiazol-3-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[5-(1-azanyl-3-methylsulfanyl-propyl)-1,2,4-oxadiazol-3-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[5-(1-amino-3-methylsulfanyl-propyl)-1,2,4-oxadiazol-3-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[5-[1-amino-3-(methylthio)propyl]-1,2,4-oxadiazol-3-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[5-(1-amino-3-methylsulfanylpropyl)-1,2,4-oxadiazol-3-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[5-[1-amino-3-(methylthio)propyl]-1,2,4-oxadiazol-3-ylidene]cyclohexa-2,5-dien-1-one Formula: C12H15N3O2S MolecularWeight: 265.3314

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C1=NC(=C2C=CC(=O)C=C2)NO1)N

Isomeric SMILES

CSCCC(C1=NC(=C2C=CC(=O)C=C2)NO1)N

InChI

InChI=1S/C12H15N3O2S/c1-18-7-6-10(13)12-14-11(15-17-12)8-2-4-9(16)5-3-8/h2-5,10,15H,6-7,13H2,1H3