methyl 5-methyl-2-(nonylcarbamothioylamino)thiophene-3-carboxylate

Systemtic Name: methyl 5-methyl-2-(nonylcarbamothioylamino)thiophene-3-carboxylate Openeye Name: methyl 5-methyl-2-(nonylcarbamothioylamino)thiophene-3-carboxylate CAS Name: 5-methyl-2-[[(nonylamino)-sulfanylidenemethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-methyl-2-(nonylcarbamothioylamino)thiophene-3-carboxylate Traditional Name: 5-methyl-2-(nonylthiocarbamoylamino)thiophene-3-carboxylic acid methyl ester Formula: C17H28N2O2S2 MolecularWeight: 356.54642

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCNC(=S)NC1=C(C=C(S1)C)C(=O)OC

Isomeric SMILES

CCCCCCCCCNC(=S)NC1=C(C=C(S1)C)C(=O)OC

InChI

InChI=1S/C17H28N2O2S2/c1-4-5-6-7-8-9-10-11-18-17(22)19-15-14(16(20)21-3)12-13(2)23-15/h12H,4-11H2,1-3H3,(H2,18,19,22)