dimethyl 5-(cyclooctylcarbamothioylamino)-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 5-(cyclooctylcarbamothioylamino)-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-(cyclooctylcarbamothioylamino)-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[(cyclooctylamino)-sulfanylidenemethyl]amino]-3-methylthiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-(cyclooctylcarbamothioylamino)-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-(cyclooctylthiocarbamoylamino)-3-methyl-thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C18H26N2O4S2 MolecularWeight: 398.54004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=S)NC2CCCCCCC2)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=S)NC2CCCCCCC2)C(=O)OC

InChI

InChI=1S/C18H26N2O4S2/c1-11-13(16(21)23-2)15(26-14(11)17(22)24-3)20-18(25)19-12-9-7-5-4-6-8-10-12/h12H,4-10H2,1-3H3,(H2,19,20,25)