ethyl 1-(2-methylprop-2-enylsulfanyl)-3-(phenylcarbonyl)thieno[3,4-b]indolizine-4-carboxylate

Systemtic Name: ethyl 1-(2-methylprop-2-enylsulfanyl)-3-(phenylcarbonyl)thieno[3,4-b]indolizine-4-carboxylate Openeye Name: ethyl 3-benzoyl-1-(2-methylallylsulfanyl)thieno[3,4-b]indolizine-4-carboxylate CAS Name: 3-benzoyl-1-(2-methylprop-2-enylthio)-4-thieno[3,4-b]indolizinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-benzoyl-1-(2-methylprop-2-enylsulfanyl)thieno[3,4-b]indolizine-4-carboxylate Traditional Name: 3-benzoyl-1-(2-methylallylthio)thien[3,4-b]indolizine-4-carboxylic acid ethyl ester Formula: C24H21NO3S2 MolecularWeight: 435.55844

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2C=CC=CN2C3=C(SC(=C13)C(=O)C4=CC=CC=C4)SCC(=C)C

Isomeric SMILES

CCOC(=O)C1=C2C=CC=CN2C3=C(SC(=C13)C(=O)C4=CC=CC=C4)SCC(=C)C

InChI

InChI=1S/C24H21NO3S2/c1-4-28-23(27)18-17-12-8-9-13-25(17)20-19(18)22(30-24(20)29-14-15(2)3)21(26)16-10-6-5-7-11-16/h5-13H,2,4,14H2,1,3H3