diethyl 2-[[5-(diethylcarbamoyl)-3-methoxycarbonyl-4-methyl-thiophen-2-yl]carbamothioylamino]benzene-1,4-dicarboxylate

Systemtic Name: diethyl 2-[[5-(diethylcarbamoyl)-3-methoxycarbonyl-4-methyl-thiophen-2-yl]carbamothioylamino]benzene-1,4-dicarboxylate Openeye Name: diethyl 2-[[5-(diethylcarbamoyl)-3-methoxycarbonyl-4-methyl-2-thienyl]carbamothioylamino]benzene-1,4-dicarboxylate CAS Name: 2-[[[[5-[diethylamino(oxo)methyl]-3-methoxycarbonyl-4-methyl-2-thiophenyl]amino]-sulfanylidenemethyl]amino]benzene-1,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2-[[5-(diethylcarbamoyl)-3-methoxycarbonyl-4-methylthiophen-2-yl]carbamothioylamino]benzene-1,4-dicarboxylate Traditional Name: 2-[[3-carbomethoxy-5-(diethylcarbamoyl)-4-methyl-2-thienyl]thiocarbamoylamino]benzene-1,4-dicarboxylic acid diethyl ester Formula: C25H31N3O7S2 MolecularWeight: 549.65954

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=S)NC2=C(C=CC(=C2)C(=O)OCC)C(=O)OCC)C(=O)OC)C

Isomeric SMILES

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=S)NC2=C(C=CC(=C2)C(=O)OCC)C(=O)OCC)C(=O)OC)C

InChI

InChI=1S/C25H31N3O7S2/c1-7-28(8-2)21(29)19-14(5)18(24(32)33-6)20(37-19)27-25(36)26-17-13-15(22(30)34-9-3)11-12-16(17)23(31)35-10-4/h11-13H,7-10H2,1-6H3,(H2,26,27,36)