dimethyl 5-(4-methylphenyl)carbothioyl-2,3-dihydropyrrolizine-1,1-dicarboxylate

Systemtic Name: dimethyl 5-(4-methylphenyl)carbothioyl-2,3-dihydropyrrolizine-1,1-dicarboxylate Openeye Name: dimethyl 5-(4-methylbenzenecarbothioyl)-2,3-dihydropyrrolizine-1,1-dicarboxylate CAS Name: 5-[(4-methylphenyl)-sulfanylidenemethyl]-2,3-dihydropyrrolizine-1,1-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-(4-methylbenzenecarbothioyl)-2,3-dihydropyrrolizine-1,1-dicarboxylate Traditional Name: 5-(4-methylthiobenzoyl)-2,3-dihydropyrrolizine-1,1-dicarboxylic acid dimethyl ester Formula: C19H19NO4S MolecularWeight: 357.42346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=S)C2=CC=C3N2CCC3(C(=O)OC)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C(=S)C2=CC=C3N2CCC3(C(=O)OC)C(=O)OC

InChI

InChI=1S/C19H19NO4S/c1-12-4-6-13(7-5-12)16(25)14-8-9-15-19(17(21)23-2,18(22)24-3)10-11-20(14)15/h4-9H,10-11H2,1-3H3