1,3-benzothiazol-2-ylmethyl 5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carboxylate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carboxylate Openeye Name: 1,3-benzothiazol-2-ylmethyl 5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carboxylate CAS Name: 5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carboxylic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carboxylate Traditional Name: 5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carboxylic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C18H17NO2S2 MolecularWeight: 343.46308

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(CC1)SC(=C2)C(=O)OCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CCC2=C(CC1)SC(=C2)C(=O)OCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C18H17NO2S2/c20-18(16-10-12-6-2-1-3-8-14(12)22-16)21-11-17-19-13-7-4-5-9-15(13)23-17/h4-5,7,9-10H,1-3,6,8,11H2