methyl 3-[[2-(aminocarbonylamino)-3-methyl-butanoyl]amino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[[2-(aminocarbonylamino)-3-methyl-butanoyl]amino]thiophene-2-carboxylate Openeye Name: methyl 3-[(3-methyl-2-ureido-butanoyl)amino]thiophene-2-carboxylate CAS Name: 3-[[2-(carbamoylamino)-3-methyl-1-oxobutyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[2-(carbamoylamino)-3-methylbutanoyl]amino]thiophene-2-carboxylate Traditional Name: 3-[(3-methyl-2-ureido-butanoyl)amino]thiophene-2-carboxylic acid methyl ester Formula: C12H17N3O4S MolecularWeight: 299.34608

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=C(SC=C1)C(=O)OC)NC(=O)N

Isomeric SMILES

CC(C)C(C(=O)NC1=C(SC=C1)C(=O)OC)NC(=O)N

InChI

InChI=1S/C12H17N3O4S/c1-6(2)8(15-12(13)18)10(16)14-7-4-5-20-9(7)11(17)19-3/h4-6,8H,1-3H3,(H,14,16)(H3,13,15,18)