(E)-3-azanyl-2-[2-[(4,5-dithiophen-2-yl-1H-imidazol-2-yl)sulfanyl]ethanoyl]but-2-enenitrile

Systemtic Name: (E)-3-azanyl-2-[2-[(4,5-dithiophen-2-yl-1H-imidazol-2-yl)sulfanyl]ethanoyl]but-2-enenitrile Openeye Name: (E)-3-amino-2-[2-[[4,5-bis(2-thienyl)-1H-imidazol-2-yl]sulfanyl]acetyl]but-2-enenitrile CAS Name: (E)-3-amino-2-[2-[(4,5-dithiophen-2-yl-1H-imidazol-2-yl)thio]-1-oxoethyl]-2-butenenitrile IUPAC Name: (E)-3-amino-2-[2-[(4,5-dithiophen-2-yl-1H-imidazol-2-yl)sulfanyl]acetyl]but-2-enenitrile Traditional Name: (E)-3-amino-2-[2-[[4,5-bis(2-thienyl)-1H-imidazol-2-yl]thio]acetyl]but-2-enenitrile Formula: C17H14N4OS3 MolecularWeight: 386.51426

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C#N)C(=O)CSC1=NC(=C(N1)C2=CC=CS2)C3=CC=CS3)N

Isomeric SMILES

C/C(=C(/C#N)\C(=O)CSC1=NC(=C(N1)C2=CC=CS2)C3=CC=CS3)/N

InChI

InChI=1S/C17H14N4OS3/c1-10(19)11(8-18)12(22)9-25-17-20-15(13-4-2-6-23-13)16(21-17)14-5-3-7-24-14/h2-7H,9,19H2,1H3,(H,20,21)/b11-10+