2-[(2-sulfanylidene-1,3-dihydrobenzimidazol-5-yl)amino]oct-1-en-3,5,7-triyn-1-one

Systemtic Name: 2-[(2-sulfanylidene-1,3-dihydrobenzimidazol-5-yl)amino]oct-1-en-3,5,7-triyn-1-one Openeye Name: 2-[(2-thioxo-1,3-dihydrobenzimidazol-5-yl)amino]oct-1-en-3,5,7-triyn-1-one CAS Name: 2-[(2-sulfanylidene-1,3-dihydrobenzimidazol-5-yl)amino]-1-oct-1-en-3,5,7-triynone IUPAC Name: 2-[(2-sulfanylidene-1,3-dihydrobenzimidazol-5-yl)amino]oct-1-en-3,5,7-triyn-1-one Traditional Name: 2-[(2-thioxo-1,3-dihydrobenzimidazol-5-yl)amino]oct-1-en-3,5,7-triyn-1-one Formula: C15H7N3OS MolecularWeight: 277.30058

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Descriptors Computed from Structure

Canonical SMILES:

C#CC#CC#CC(=C=O)NC1=CC2=C(C=C1)NC(=S)N2

Isomeric SMILES

C#CC#CC#CC(=C=O)NC1=CC2=C(C=C1)NC(=S)N2

InChI

InChI=1S/C15H7N3OS/c1-2-3-4-5-6-12(10-19)16-11-7-8-13-14(9-11)18-15(20)17-13/h1,7-9,16H,(H2,17,18,20)