4-[(6-chloranyl-1,3-benzothiazol-2-yl)carbamoylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(6-chloranyl-1,3-benzothiazol-2-yl)carbamoylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[(6-chloro-1,3-benzothiazol-2-yl)carbamoylamino]-4-oxo-butanoic acid CAS Name: 4-[[[(6-chloro-1,3-benzothiazol-2-yl)amino]-oxomethyl]amino]-4-oxobutanoic acid IUPAC Name: 4-[(6-chloro-1,3-benzothiazol-2-yl)carbamoylamino]-4-oxobutanoic acid Traditional Name: 4-[(6-chloro-1,3-benzothiazol-2-yl)carbamoylamino]-4-keto-butyric acid Formula: C12H10ClN3O4S MolecularWeight: 327.7435

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)SC(=N2)NC(=O)NC(=O)CCC(=O)O

Isomeric SMILES

C1=CC2=C(C=C1Cl)SC(=N2)NC(=O)NC(=O)CCC(=O)O

InChI

InChI=1S/C12H10ClN3O4S/c13-6-1-2-7-8(5-6)21-12(14-7)16-11(20)15-9(17)3-4-10(18)19/h1-2,5H,3-4H2,(H,18,19)(H2,14,15,16,17,20)