methyl 5-[2-(1,3-benzothiazol-2-ylamino)-2-oxidanylidene-ethyl]sulfanyl-2-phenyl-1,3-oxazole-4-carboxylate

Systemtic Name: methyl 5-[2-(1,3-benzothiazol-2-ylamino)-2-oxidanylidene-ethyl]sulfanyl-2-phenyl-1,3-oxazole-4-carboxylate Openeye Name: methyl 5-[2-(1,3-benzothiazol-2-ylamino)-2-oxo-ethyl]sulfanyl-2-phenyl-oxazole-4-carboxylate CAS Name: 5-[[2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl]thio]-2-phenyl-4-oxazolecarboxylic acid methyl ester IUPAC Name: methyl 5-[2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl]sulfanyl-2-phenyl-1,3-oxazole-4-carboxylate Traditional Name: 5-[[2-(1,3-benzothiazol-2-ylamino)-2-keto-ethyl]thio]-2-phenyl-oxazole-4-carboxylic acid methyl ester Formula: C20H15N3O4S2 MolecularWeight: 425.4808

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(OC(=N1)C2=CC=CC=C2)SCC(=O)NC3=NC4=CC=CC=C4S3

Isomeric SMILES

COC(=O)C1=C(OC(=N1)C2=CC=CC=C2)SCC(=O)NC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H15N3O4S2/c1-26-18(25)16-19(27-17(23-16)12-7-3-2-4-8-12)28-11-15(24)22-20-21-13-9-5-6-10-14(13)29-20/h2-10H,11H2,1H3,(H,21,22,24)