4-[5-(aminomethyl)-1,2,4-thiadiazol-3-ylidene]-2,6-ditert-butyl-cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[5-(aminomethyl)-1,2,4-thiadiazol-3-ylidene]-2,6-ditert-butyl-cyclohexa-2,5-dien-1-one Openeye Name: 4-[5-(aminomethyl)-1,2,4-thiadiazol-3-ylidene]-2,6-ditert-butyl-cyclohexa-2,5-dien-1-one CAS Name: 4-[5-(aminomethyl)-1,2,4-thiadiazol-3-ylidene]-2,6-ditert-butyl-1-cyclohexa-2,5-dienone IUPAC Name: 4-[5-(aminomethyl)-1,2,4-thiadiazol-3-ylidene]-2,6-ditert-butylcyclohexa-2,5-dien-1-one Traditional Name: 4-[5-(aminomethyl)-1,2,4-thiadiazol-3-ylidene]-2,6-ditert-butyl-cyclohexa-2,5-dien-1-one Formula: C17H25N3OS MolecularWeight: 319.4649

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C2NSC(=N2)CN)C=C(C1=O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=C2NSC(=N2)CN)C=C(C1=O)C(C)(C)C

InChI

InChI=1S/C17H25N3OS/c1-16(2,3)11-7-10(15-19-13(9-18)22-20-15)8-12(14(11)21)17(4,5)6/h7-8,20H,9,18H2,1-6H3