dimethyl 5-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butylcarbamothioylamino]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 5-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butylcarbamothioylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-[4-[2,4-bis(1,1-dimethylpropyl)phenoxy]butylcarbamothioylamino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butylamino]-sulfanylidenemethyl]amino]-3-methylthiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butylcarbamothioylamino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[4-(2,4-ditert-amylphenoxy)butylthiocarbamoylamino]-3-methyl-thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C30H44N2O5S2 MolecularWeight: 576.81076

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC(=C(C=C1)OCCCCNC(=S)NC2=C(C(=C(S2)C(=O)OC)C)C(=O)OC)C(C)(C)CC

Isomeric SMILES

CCC(C)(C)C1=CC(=C(C=C1)OCCCCNC(=S)NC2=C(C(=C(S2)C(=O)OC)C)C(=O)OC)C(C)(C)CC

InChI

InChI=1S/C30H44N2O5S2/c1-10-29(4,5)20-14-15-22(21(18-20)30(6,7)11-2)37-17-13-12-16-31-28(38)32-25-23(26(33)35-8)19(3)24(39-25)27(34)36-9/h14-15,18H,10-13,16-17H2,1-9H3,(H2,31,32,38)