methyl 4-[3-(1,3-benzothiazol-2-ylamino)-3-oxidanylidene-propyl]-2-methoxy-benzoate

Systemtic Name: methyl 4-[3-(1,3-benzothiazol-2-ylamino)-3-oxidanylidene-propyl]-2-methoxy-benzoate Openeye Name: methyl 4-[3-(1,3-benzothiazol-2-ylamino)-3-oxo-propyl]-2-methoxy-benzoate CAS Name: 4-[3-(1,3-benzothiazol-2-ylamino)-3-oxopropyl]-2-methoxybenzoic acid methyl ester IUPAC Name: methyl 4-[3-(1,3-benzothiazol-2-ylamino)-3-oxopropyl]-2-methoxybenzoate Traditional Name: 4-[3-(1,3-benzothiazol-2-ylamino)-3-keto-propyl]-2-methoxy-benzoic acid methyl ester Formula: C19H18N2O4S MolecularWeight: 370.42222

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CCC(=O)NC2=NC3=CC=CC=C3S2)C(=O)OC

Isomeric SMILES

COC1=C(C=CC(=C1)CCC(=O)NC2=NC3=CC=CC=C3S2)C(=O)OC

InChI

InChI=1S/C19H18N2O4S/c1-24-15-11-12(7-9-13(15)18(23)25-2)8-10-17(22)21-19-20-14-5-3-4-6-16(14)26-19/h3-7,9,11H,8,10H2,1-2H3,(H,20,21,22)