1,3-benzothiazol-2-ylmethyl 4-(1,3-dithian-2-yl)benzoate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 4-(1,3-dithian-2-yl)benzoate Openeye Name: 1,3-benzothiazol-2-ylmethyl 4-(1,3-dithian-2-yl)benzoate CAS Name: 4-(1,3-dithian-2-yl)benzoic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 4-(1,3-dithian-2-yl)benzoate Traditional Name: 4-(1,3-dithian-2-yl)benzoic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C19H17NO2S3 MolecularWeight: 387.53878

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(SC1)C2=CC=C(C=C2)C(=O)OCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CSC(SC1)C2=CC=C(C=C2)C(=O)OCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C19H17NO2S3/c21-18(22-12-17-20-15-4-1-2-5-16(15)25-17)13-6-8-14(9-7-13)19-23-10-3-11-24-19/h1-2,4-9,19H,3,10-12H2