2-[[2-(aminocarbonylamino)-4-methylsulfanyl-butanoyl]amino]thiophene-3-carboxylic acid

Systemtic Name: 2-[[2-(aminocarbonylamino)-4-methylsulfanyl-butanoyl]amino]thiophene-3-carboxylic acid Openeye Name: 2-[(4-methylsulfanyl-2-ureido-butanoyl)amino]thiophene-3-carboxylic acid CAS Name: 2-[[2-(carbamoylamino)-4-(methylthio)-1-oxobutyl]amino]-3-thiophenecarboxylic acid IUPAC Name: 2-[[2-(carbamoylamino)-4-methylsulfanylbutanoyl]amino]thiophene-3-carboxylic acid Traditional Name: 2-[[4-(methylthio)-2-ureido-butanoyl]amino]-3-thenoic acid Formula: C11H15N3O4S2 MolecularWeight: 317.3845

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H15N3O4S2/c1-19-4-3-7(13-11(12)18)8(15)14-9-6(10(16)17)2-5-20-9/h2,5,7H,3-4H2,1H3,(H,14,15)(H,16,17)(H3,12,13,18)