5-[(5,6-dimethyl-1,3-benzothiazol-2-yl)amino]-5-oxidanylidene-pentanoate

Systemtic Name: 5-[(5,6-dimethyl-1,3-benzothiazol-2-yl)amino]-5-oxidanylidene-pentanoate Openeye Name: 5-[(5,6-dimethyl-1,3-benzothiazol-2-yl)amino]-5-oxo-pentanoate CAS Name: 5-[(5,6-dimethyl-1,3-benzothiazol-2-yl)amino]-5-oxopentanoate IUPAC Name: 5-[(5,6-dimethyl-1,3-benzothiazol-2-yl)amino]-5-oxopentanoate Traditional Name: 5-[(5,6-dimethyl-1,3-benzothiazol-2-yl)amino]-5-keto-valerate Formula: C14H15N2O3S- MolecularWeight: 291.3455

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)SC(=N2)NC(=O)CCCC(=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1C)SC(=N2)NC(=O)CCCC(=O)[O-]

InChI

InChI=1S/C14H16N2O3S/c1-8-6-10-11(7-9(8)2)20-14(15-10)16-12(17)4-3-5-13(18)19/h6-7H,3-5H2,1-2H3,(H,18,19)(H,15,16,17)/p-1