ethyl 5-(4-chlorophenyl)-4-thiocyanato-1H-pyrrole-2-carboxylate

Systemtic Name: ethyl 5-(4-chlorophenyl)-4-thiocyanato-1H-pyrrole-2-carboxylate Openeye Name: ethyl 5-(4-chlorophenyl)-4-thiocyanato-1H-pyrrole-2-carboxylate CAS Name: 5-(4-chlorophenyl)-4-thiocyanato-1H-pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-(4-chlorophenyl)-4-thiocyanato-1H-pyrrole-2-carboxylate Traditional Name: 5-(4-chlorophenyl)-4-thiocyanato-1H-pyrrole-2-carboxylic acid ethyl ester Formula: C14H11ClN2O2S MolecularWeight: 306.76734

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(N1)C2=CC=C(C=C2)Cl)SC#N

Isomeric SMILES

CCOC(=O)C1=CC(=C(N1)C2=CC=C(C=C2)Cl)SC#N

InChI

InChI=1S/C14H11ClN2O2S/c1-2-19-14(18)11-7-12(20-8-16)13(17-11)9-3-5-10(15)6-4-9/h3-7,17H,2H2,1H3