2-oxidanylidenepropyl 4-(1,3-benzothiazol-2-ylsulfanylmethyl)benzoate

Systemtic Name: 2-oxidanylidenepropyl 4-(1,3-benzothiazol-2-ylsulfanylmethyl)benzoate Openeye Name: acetonyl 4-(1,3-benzothiazol-2-ylsulfanylmethyl)benzoate CAS Name: 4-[(1,3-benzothiazol-2-ylthio)methyl]benzoic acid 2-oxopropyl ester IUPAC Name: 2-oxopropyl 4-(1,3-benzothiazol-2-ylsulfanylmethyl)benzoate Traditional Name: 4-[(1,3-benzothiazol-2-ylthio)methyl]benzoic acid acetonyl ester Formula: C18H15NO3S2 MolecularWeight: 357.4466

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)COC(=O)C1=CC=C(C=C1)CSC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(=O)COC(=O)C1=CC=C(C=C1)CSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H15NO3S2/c1-12(20)10-22-17(21)14-8-6-13(7-9-14)11-23-18-19-15-4-2-3-5-16(15)24-18/h2-9H,10-11H2,1H3