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

Systemtic Name: methyl 3-[[2-(aminocarbonylamino)-3-methyl-pentanoyl]amino]thiophene-2-carboxylate Openeye Name: methyl 3-[(3-methyl-2-ureido-pentanoyl)amino]thiophene-2-carboxylate CAS Name: 3-[[2-(carbamoylamino)-3-methyl-1-oxopentyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[2-(carbamoylamino)-3-methylpentanoyl]amino]thiophene-2-carboxylate Traditional Name: 3-[(3-methyl-2-ureido-pentanoyl)amino]thiophene-2-carboxylic acid methyl ester Formula: C13H19N3O4S MolecularWeight: 313.37266

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19N3O4S/c1-4-7(2)9(16-13(14)19)11(17)15-8-5-6-21-10(8)12(18)20-3/h5-7,9H,4H2,1-3H3,(H,15,17)(H3,14,16,19)