methyl 3-(4-propan-2-ylphenyl)carbothioyl-5,6,7,8-tetrahydroindolizine-8-carboxylate

Systemtic Name: methyl 3-(4-propan-2-ylphenyl)carbothioyl-5,6,7,8-tetrahydroindolizine-8-carboxylate Openeye Name: methyl 3-(4-isopropylbenzenecarbothioyl)-5,6,7,8-tetrahydroindolizine-8-carboxylate CAS Name: 3-[(4-propan-2-ylphenyl)-sulfanylidenemethyl]-5,6,7,8-tetrahydroindolizine-8-carboxylic acid methyl ester IUPAC Name: methyl 3-(4-propan-2-ylbenzenecarbothioyl)-5,6,7,8-tetrahydroindolizine-8-carboxylate Traditional Name: 3-(4-isopropylthiobenzoyl)-5,6,7,8-tetrahydroindolizine-8-carboxylic acid methyl ester Formula: C20H23NO2S MolecularWeight: 341.46712

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(=S)C2=CC=C3N2CCCC3C(=O)OC

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(=S)C2=CC=C3N2CCCC3C(=O)OC

InChI

InChI=1S/C20H23NO2S/c1-13(2)14-6-8-15(9-7-14)19(24)18-11-10-17-16(20(22)23-3)5-4-12-21(17)18/h6-11,13,16H,4-5,12H2,1-3H3