ethyl 2-isothiocyanato-4-propan-2-yl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-isothiocyanato-4-propan-2-yl-thiophene-3-carboxylate Openeye Name: ethyl 4-isopropyl-2-isothiocyanato-thiophene-3-carboxylate CAS Name: 2-isothiocyanato-4-propan-2-yl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-isothiocyanato-4-propan-2-ylthiophene-3-carboxylate Traditional Name: 4-isopropyl-2-isothiocyanato-thiophene-3-carboxylic acid ethyl ester Formula: C11H13NO2S2 MolecularWeight: 255.35642

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C(C)C)N=C=S

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C(C)C)N=C=S

InChI

InChI=1S/C11H13NO2S2/c1-4-14-11(13)9-8(7(2)3)5-16-10(9)12-6-15/h5,7H,4H2,1-3H3