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

Systemtic Name: ethyl 1-(3-methylbut-2-enylsulfanyl)-3-(phenylcarbonyl)thieno[3,4-b]indolizine-4-carboxylate Openeye Name: ethyl 3-benzoyl-1-(3-methylbut-2-enylsulfanyl)thieno[3,4-b]indolizine-4-carboxylate CAS Name: 3-benzoyl-1-(3-methylbut-2-enylthio)-4-thieno[3,4-b]indolizinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-benzoyl-1-(3-methylbut-2-enylsulfanyl)thieno[3,4-b]indolizine-4-carboxylate Traditional Name: 3-benzoyl-1-(3-methylbut-2-enylthio)thien[3,4-b]indolizine-4-carboxylic acid ethyl ester Formula: C25H23NO3S2 MolecularWeight: 449.58502

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C25H23NO3S2/c1-4-29-24(28)19-18-12-8-9-14-26(18)21-20(19)23(22(27)17-10-6-5-7-11-17)31-25(21)30-15-13-16(2)3/h5-14H,4,15H2,1-3H3