[1-(ethylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 3-(1,3-benzothiazol-2-yl)propanoate

Systemtic Name: [1-(ethylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 3-(1,3-benzothiazol-2-yl)propanoate Openeye Name: [2-(ethylcarbamoylamino)-1-methyl-2-oxo-ethyl] 3-(1,3-benzothiazol-2-yl)propanoate CAS Name: 3-(1,3-benzothiazol-2-yl)propanoic acid [1-(ethylcarbamoylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(ethylcarbamoylamino)-1-oxopropan-2-yl] 3-(1,3-benzothiazol-2-yl)propanoate Traditional Name: 3-(1,3-benzothiazol-2-yl)propionic acid [2-(ethylcarbamoylamino)-2-keto-1-methyl-ethyl] ester Formula: C16H19N3O4S MolecularWeight: 349.40476

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC(=O)C(C)OC(=O)CCC1=NC2=CC=CC=C2S1

Isomeric SMILES

CCNC(=O)NC(=O)C(C)OC(=O)CCC1=NC2=CC=CC=C2S1

InChI

InChI=1S/C16H19N3O4S/c1-3-17-16(22)19-15(21)10(2)23-14(20)9-8-13-18-11-6-4-5-7-12(11)24-13/h4-7,10H,3,8-9H2,1-2H3,(H2,17,19,21,22)