ethanoyl fluoride; 4-(1,3-thiazol-2-ylamino)-1-benzothiophene-2-carboximidamide

Systemtic Name: ethanoyl fluoride; 4-(1,3-thiazol-2-ylamino)-1-benzothiophene-2-carboximidamide Openeye Name: acetyl fluoride; 4-(thiazol-2-ylamino)benzothiophene-2-carboxamidine CAS Name: acetyl fluoride; 4-(2-thiazolylamino)-1-benzothiophene-2-carboximidamide IUPAC Name: acetyl fluoride; 4-(1,3-thiazol-2-ylamino)-1-benzothiophene-2-carboximidamide Traditional Name: acetyl fluoride; 4-(thiazol-2-ylamino)benzothiophene-2-carboxamidine Formula: C18H19F3N4O3S2 MolecularWeight: 460.49367

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)F.CC(=O)F.CC(=O)F.C1=CC(=C2C=C(SC2=C1)C(=N)N)NC3=NC=CS3

Isomeric SMILES

CC(=O)F.CC(=O)F.CC(=O)F.C1=CC(=C2C=C(SC2=C1)C(=N)N)NC3=NC=CS3

InChI

InChI=1S/C12H10N4S2.3C2H3FO/c13-11(14)10-6-7-8(2-1-3-9(7)18-10)16-12-15-4-5-17-12;3*1-2(3)4/h1-6H,(H3,13,14)(H,15,16);3*1H3