dimethyl 5-azanyl-3-[[3-methyl-2-[(3-methylphenyl)carbonylamino]butanoyl]oxymethyl]thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 5-azanyl-3-[[3-methyl-2-[(3-methylphenyl)carbonylamino]butanoyl]oxymethyl]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-amino-3-[[3-methyl-2-[(3-methylbenzoyl)amino]butanoyl]oxymethyl]thiophene-2,4-dicarboxylate CAS Name: 5-amino-3-[[3-methyl-2-[[(3-methylphenyl)-oxomethyl]amino]-1-oxobutoxy]methyl]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-amino-3-[[3-methyl-2-[(3-methylbenzoyl)amino]butanoyl]oxymethyl]thiophene-2,4-dicarboxylate Traditional Name: 5-amino-3-[[3-methyl-2-(m-toluoylamino)butanoyl]oxymethyl]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C22H26N2O7S MolecularWeight: 462.51604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC(C(C)C)C(=O)OCC2=C(SC(=C2C(=O)OC)N)C(=O)OC

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC(C(C)C)C(=O)OCC2=C(SC(=C2C(=O)OC)N)C(=O)OC

InChI

InChI=1S/C22H26N2O7S/c1-11(2)16(24-19(25)13-8-6-7-12(3)9-13)21(27)31-10-14-15(20(26)29-4)18(23)32-17(14)22(28)30-5/h6-9,11,16H,10,23H2,1-5H3,(H,24,25)