ethyl 1-methyl-3-(phenylsulfanylmethyl)thieno[2,3-c]pyrazole-5-carboxylate

Systemtic Name: ethyl 1-methyl-3-(phenylsulfanylmethyl)thieno[2,3-c]pyrazole-5-carboxylate Openeye Name: ethyl 1-methyl-3-(phenylsulfanylmethyl)thieno[2,3-c]pyrazole-5-carboxylate CAS Name: 1-methyl-3-[(phenylthio)methyl]-5-thieno[2,3-c]pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-methyl-3-(phenylsulfanylmethyl)thieno[2,3-c]pyrazole-5-carboxylate Traditional Name: 1-methyl-3-[(phenylthio)methyl]thieno[2,3-c]pyrazole-5-carboxylic acid ethyl ester Formula: C16H16N2O2S2 MolecularWeight: 332.44044

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(S1)N(N=C2CSC3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=CC2=C(S1)N(N=C2CSC3=CC=CC=C3)C

InChI

InChI=1S/C16H16N2O2S2/c1-3-20-16(19)14-9-12-13(17-18(2)15(12)22-14)10-21-11-7-5-4-6-8-11/h4-9H,3,10H2,1-2H3