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

Systemtic Name: 2-[[2-(aminocarbonylamino)-3-methyl-pentanoyl]amino]thiophene-3-carboxylic acid Openeye Name: 2-[(3-methyl-2-ureido-pentanoyl)amino]thiophene-3-carboxylic acid CAS Name: 2-[[2-(carbamoylamino)-3-methyl-1-oxopentyl]amino]-3-thiophenecarboxylic acid IUPAC Name: 2-[[2-(carbamoylamino)-3-methylpentanoyl]amino]thiophene-3-carboxylic acid Traditional Name: 2-[(3-methyl-2-ureido-pentanoyl)amino]-3-thenoic acid Formula: C12H17N3O4S MolecularWeight: 299.34608

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC1=C(C=CS1)C(=O)O)NC(=O)N

Isomeric SMILES

CCC(C)C(C(=O)NC1=C(C=CS1)C(=O)O)NC(=O)N

InChI

InChI=1S/C12H17N3O4S/c1-3-6(2)8(14-12(13)19)9(16)15-10-7(11(17)18)4-5-20-10/h4-6,8H,3H2,1-2H3,(H,15,16)(H,17,18)(H3,13,14,19)