4-[(2-azanyl-1,3-benzothiazol-6-yl)carbonylamino]cyclohexane-1-carboxylate

Systemtic Name: 4-[(2-azanyl-1,3-benzothiazol-6-yl)carbonylamino]cyclohexane-1-carboxylate Openeye Name: 4-[(2-amino-1,3-benzothiazole-6-carbonyl)amino]cyclohexanecarboxylate CAS Name: 4-[[(2-amino-1,3-benzothiazol-6-yl)-oxomethyl]amino]-1-cyclohexanecarboxylate IUPAC Name: 4-[(2-amino-1,3-benzothiazole-6-carbonyl)amino]cyclohexane-1-carboxylate Traditional Name: 4-[(2-amino-1,3-benzothiazole-6-carbonyl)amino]cyclohexanecarboxylate Formula: C15H16N3O3S- MolecularWeight: 318.37084

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C(=O)[O-])NC(=O)C2=CC3=C(C=C2)N=C(S3)N

Isomeric SMILES

C1CC(CCC1C(=O)[O-])NC(=O)C2=CC3=C(C=C2)N=C(S3)N

InChI

InChI=1S/C15H17N3O3S/c16-15-18-11-6-3-9(7-12(11)22-15)13(19)17-10-4-1-8(2-5-10)14(20)21/h3,6-8,10H,1-2,4-5H2,(H2,16,18)(H,17,19)(H,20,21)/p-1