naphthalen-1-ylmethyl 4-(1,3-thiazol-4-ylmethylsulfanyl)benzoate

Systemtic Name: naphthalen-1-ylmethyl 4-(1,3-thiazol-4-ylmethylsulfanyl)benzoate Openeye Name: 1-naphthylmethyl 4-(thiazol-4-ylmethylsulfanyl)benzoate CAS Name: 4-(4-thiazolylmethylthio)benzoic acid 1-naphthalenylmethyl ester IUPAC Name: naphthalen-1-ylmethyl 4-(1,3-thiazol-4-ylmethylsulfanyl)benzoate Traditional Name: 4-(thiazol-4-ylmethylthio)benzoic acid 1-naphthylmethyl ester Formula: C22H17NO2S2 MolecularWeight: 391.50588

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2COC(=O)C3=CC=C(C=C3)SCC4=CSC=N4

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2COC(=O)C3=CC=C(C=C3)SCC4=CSC=N4

InChI

InChI=1S/C22H17NO2S2/c24-22(25-12-18-6-3-5-16-4-1-2-7-21(16)18)17-8-10-20(11-9-17)27-14-19-13-26-15-23-19/h1-11,13,15H,12,14H2