[1-(2-acetamidophenyl)pyrrol-2-yl] thiocyanate

Systemtic Name: [1-(2-acetamidophenyl)pyrrol-2-yl] thiocyanate Openeye Name: [1-(2-acetamidophenyl)pyrrol-2-yl] thiocyanate CAS Name: thiocyanic acid [1-(2-acetamidophenyl)-2-pyrrolyl] ester IUPAC Name: [1-(2-acetamidophenyl)pyrrol-2-yl] thiocyanate Traditional Name: thiocyanic acid [1-(2-acetamidophenyl)pyrrol-2-yl] ester Formula: C13H11N3OS MolecularWeight: 257.31094

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC=C1N2C=CC=C2SC#N

Isomeric SMILES

CC(=O)NC1=CC=CC=C1N2C=CC=C2SC#N

InChI

InChI=1S/C13H11N3OS/c1-10(17)15-11-5-2-3-6-12(11)16-8-4-7-13(16)18-9-14/h2-8H,1H3,(H,15,17)