[1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 4-(2,5-dimethylthiophen-3-yl)-4-oxidanylidene-butanoate

Systemtic Name: [1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 4-(2,5-dimethylthiophen-3-yl)-4-oxidanylidene-butanoate Openeye Name: (1-allophanoyl-2-methyl-propyl) 4-(2,5-dimethyl-3-thienyl)-4-oxo-butanoate CAS Name: 4-(2,5-dimethyl-3-thiophenyl)-4-oxobutanoic acid [1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] ester IUPAC Name: [1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] 4-(2,5-dimethylthiophen-3-yl)-4-oxobutanoate Traditional Name: 4-(2,5-dimethyl-3-thienyl)-4-keto-butyric acid (1-allophanoyl-2-methyl-propyl) ester Formula: C16H22N2O5S MolecularWeight: 354.42128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(=O)CCC(=O)OC(C(C)C)C(=O)NC(=O)N

Isomeric SMILES

CC1=CC(=C(S1)C)C(=O)CCC(=O)OC(C(C)C)C(=O)NC(=O)N

InChI

InChI=1S/C16H22N2O5S/c1-8(2)14(15(21)18-16(17)22)23-13(20)6-5-12(19)11-7-9(3)24-10(11)4/h7-8,14H,5-6H2,1-4H3,(H3,17,18,21,22)