2-methoxyethyl 2-methyl-4-phenyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-b]pyridine-3-carboxylate

Systemtic Name: 2-methoxyethyl 2-methyl-4-phenyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-b]pyridine-3-carboxylate Openeye Name: 2-methoxyethyl 2-methyl-4-phenyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-b]pyridine-3-carboxylate CAS Name: 2-methyl-4-phenyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-b]pyridine-3-carboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 2-methyl-4-phenyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-b]pyridine-3-carboxylate Traditional Name: 2-methyl-4-phenyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-b]pyridine-3-carboxylic acid 2-methoxyethyl ester Formula: C22H23NO3S MolecularWeight: 381.48792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C2C3=C(CCCC3)SC2=N1)C4=CC=CC=C4)C(=O)OCCOC

Isomeric SMILES

CC1=C(C(=C2C3=C(CCCC3)SC2=N1)C4=CC=CC=C4)C(=O)OCCOC

InChI

InChI=1S/C22H23NO3S/c1-14-18(22(24)26-13-12-25-2)19(15-8-4-3-5-9-15)20-16-10-6-7-11-17(16)27-21(20)23-14/h3-5,8-9H,6-7,10-13H2,1-2H3