2-(1,2-dihydroimidazo[2,1-b][1,3]benzothiazol-7-ylcarbamoylamino)-3-methyl-butanoic acid

Systemtic Name: 2-(1,2-dihydroimidazo[2,1-b][1,3]benzothiazol-7-ylcarbamoylamino)-3-methyl-butanoic acid Openeye Name: 2-(1,2-dihydroimidazo[2,1-b][1,3]benzothiazol-7-ylcarbamoylamino)-3-methyl-butanoic acid CAS Name: 2-[[(1,2-dihydroimidazo[2,1-b][1,3]benzothiazol-7-ylamino)-oxomethyl]amino]-3-methylbutanoic acid IUPAC Name: 2-(1,2-dihydroimidazo[2,1-b][1,3]benzothiazol-7-ylcarbamoylamino)-3-methylbutanoic acid Traditional Name: 2-(1,2-dihydroimidazo[2,1-b][1,3]benzothiazol-7-ylcarbamoylamino)-3-methyl-butyric acid Formula: C15H18N4O3S MolecularWeight: 334.39342

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)NC1=CC2=C(C=C1)SC3=NCCN23

Isomeric SMILES

CC(C)C(C(=O)O)NC(=O)NC1=CC2=C(C=C1)SC3=NCCN23

InChI

InChI=1S/C15H18N4O3S/c1-8(2)12(13(20)21)18-14(22)17-9-3-4-11-10(7-9)19-6-5-16-15(19)23-11/h3-4,7-8,12H,5-6H2,1-2H3,(H,20,21)(H2,17,18,22)