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

Systemtic Name: methyl 2-(1,2-dihydroimidazo[2,1-b][1,3]benzothiazol-7-ylcarbamoylamino)-4-methylsulfanyl-butanoate Openeye Name: methyl 2-(1,2-dihydroimidazo[2,1-b][1,3]benzothiazol-7-ylcarbamoylamino)-4-methylsulfanyl-butanoate CAS Name: 2-[[(1,2-dihydroimidazo[2,1-b][1,3]benzothiazol-7-ylamino)-oxomethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl 2-(1,2-dihydroimidazo[2,1-b][1,3]benzothiazol-7-ylcarbamoylamino)-4-methylsulfanylbutanoate Traditional Name: 2-(1,2-dihydroimidazo[2,1-b][1,3]benzothiazol-7-ylcarbamoylamino)-4-(methylthio)butyric acid methyl ester Formula: C16H20N4O3S2 MolecularWeight: 380.485

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCSC)NC(=O)NC1=CC2=C(C=C1)SC3=NCCN23

Isomeric SMILES

COC(=O)C(CCSC)NC(=O)NC1=CC2=C(C=C1)SC3=NCCN23

InChI

InChI=1S/C16H20N4O3S2/c1-23-14(21)11(5-8-24-2)19-15(22)18-10-3-4-13-12(9-10)20-7-6-17-16(20)25-13/h3-4,9,11H,5-8H2,1-2H3,(H2,18,19,22)