methyl 5-ethyl-2-[[(1R)-1-phenylpropyl]carbamothioylamino]thiophene-3-carboxylate

Systemtic Name: methyl 5-ethyl-2-[[(1R)-1-phenylpropyl]carbamothioylamino]thiophene-3-carboxylate Openeye Name: methyl 5-ethyl-2-[[(1R)-1-phenylpropyl]carbamothioylamino]thiophene-3-carboxylate CAS Name: 5-ethyl-2-[[[[(1R)-1-phenylpropyl]amino]-sulfanylidenemethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-ethyl-2-[[(1R)-1-phenylpropyl]carbamothioylamino]thiophene-3-carboxylate Traditional Name: 5-ethyl-2-[[(1R)-1-phenylpropyl]thiocarbamoylamino]thiophene-3-carboxylic acid methyl ester Formula: C18H22N2O2S2 MolecularWeight: 362.50948

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=S)NC(CC)C2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=S)N[C@H](CC)C2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C18H22N2O2S2/c1-4-13-11-14(17(21)22-3)16(24-13)20-18(23)19-15(5-2)12-9-7-6-8-10-12/h6-11,15H,4-5H2,1-3H3,(H2,19,20,23)/t15-/m1/s1