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

Systemtic Name: 2-(1,2-dihydroimidazo[2,1-b][1,3]benzothiazol-7-ylcarbamoylamino)-4-methylsulfanyl-butanoic acid Openeye Name: 2-(1,2-dihydroimidazo[2,1-b][1,3]benzothiazol-7-ylcarbamoylamino)-4-methylsulfanyl-butanoic acid CAS Name: 2-[[(1,2-dihydroimidazo[2,1-b][1,3]benzothiazol-7-ylamino)-oxomethyl]amino]-4-(methylthio)butanoic acid IUPAC Name: 2-(1,2-dihydroimidazo[2,1-b][1,3]benzothiazol-7-ylcarbamoylamino)-4-methylsulfanylbutanoic acid Traditional Name: 2-(1,2-dihydroimidazo[2,1-b][1,3]benzothiazol-7-ylcarbamoylamino)-4-(methylthio)butyric acid Formula: C15H18N4O3S2 MolecularWeight: 366.45842

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18N4O3S2/c1-23-7-4-10(13(20)21)18-14(22)17-9-2-3-12-11(8-9)19-6-5-16-15(19)24-12/h2-3,8,10H,4-7H2,1H3,(H,20,21)(H2,17,18,22)