dimethyl 3-methyl-5-[3-(3-methylbutylamino)propanoylamino]thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 3-methyl-5-[3-(3-methylbutylamino)propanoylamino]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-[3-(isopentylamino)propanoylamino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[3-(3-methylbutylamino)-1-oxopropyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-methyl-5-[3-(3-methylbutylamino)propanoylamino]thiophene-2,4-dicarboxylate Traditional Name: 5-[3-(isoamylamino)propanoylamino]-3-methyl-thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C17H26N2O5S MolecularWeight: 370.46374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)CCNCCC(C)C)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)CCNCCC(C)C)C(=O)OC

InChI

InChI=1S/C17H26N2O5S/c1-10(2)6-8-18-9-7-12(20)19-15-13(16(21)23-4)11(3)14(25-15)17(22)24-5/h10,18H,6-9H2,1-5H3,(H,19,20)