2-(1,2-dihydroimidazo[2,1-b][1,3]benzothiazol-7-ylcarbamoylamino)-4-methyl-pentanoic acid

Systemtic Name: 2-(1,2-dihydroimidazo[2,1-b][1,3]benzothiazol-7-ylcarbamoylamino)-4-methyl-pentanoic acid Openeye Name: 2-(1,2-dihydroimidazo[2,1-b][1,3]benzothiazol-7-ylcarbamoylamino)-4-methyl-pentanoic acid CAS Name: 2-[[(1,2-dihydroimidazo[2,1-b][1,3]benzothiazol-7-ylamino)-oxomethyl]amino]-4-methylpentanoic acid IUPAC Name: 2-(1,2-dihydroimidazo[2,1-b][1,3]benzothiazol-7-ylcarbamoylamino)-4-methylpentanoic acid Traditional Name: 2-(1,2-dihydroimidazo[2,1-b][1,3]benzothiazol-7-ylcarbamoylamino)-4-methyl-valeric acid Formula: C16H20N4O3S MolecularWeight: 348.42

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20N4O3S/c1-9(2)7-11(14(21)22)19-15(23)18-10-3-4-13-12(8-10)20-6-5-17-16(20)24-13/h3-4,8-9,11H,5-7H2,1-2H3,(H,21,22)(H2,18,19,23)