ethyl 2-[[(1-ethyl-5-methyl-pyrazol-4-yl)methyl-methyl-carbamothioyl]amino]-5-(phenylmethyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[(1-ethyl-5-methyl-pyrazol-4-yl)methyl-methyl-carbamothioyl]amino]-5-(phenylmethyl)thiophene-3-carboxylate Openeye Name: ethyl 5-benzyl-2-[[(1-ethyl-5-methyl-pyrazol-4-yl)methyl-methyl-carbamothioyl]amino]thiophene-3-carboxylate CAS Name: 2-[[[(1-ethyl-5-methyl-4-pyrazolyl)methyl-methylamino]-sulfanylidenemethyl]amino]-5-(phenylmethyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-benzyl-2-[[(1-ethyl-5-methylpyrazol-4-yl)methyl-methylcarbamothioyl]amino]thiophene-3-carboxylate Traditional Name: 5-benzyl-2-[[(1-ethyl-5-methyl-pyrazol-4-yl)methyl-methyl-thiocarbamoyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C23H28N4O2S2 MolecularWeight: 456.62402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)CN(C)C(=S)NC2=C(C=C(S2)CC3=CC=CC=C3)C(=O)OCC)C

Isomeric SMILES

CCN1C(=C(C=N1)CN(C)C(=S)NC2=C(C=C(S2)CC3=CC=CC=C3)C(=O)OCC)C

InChI

InChI=1S/C23H28N4O2S2/c1-5-27-16(3)18(14-24-27)15-26(4)23(30)25-21-20(22(28)29-6-2)13-19(31-21)12-17-10-8-7-9-11-17/h7-11,13-14H,5-6,12,15H2,1-4H3,(H,25,30)