1-[(4-fluorophenyl)methyl]-2-oxidanylidene-4-(4-thiophen-2-ylcarbonylpiperazin-1-yl)thieno[3,4-b]pyridine-3-carbonitrile

Systemtic Name: 1-[(4-fluorophenyl)methyl]-2-oxidanylidene-4-(4-thiophen-2-ylcarbonylpiperazin-1-yl)thieno[3,4-b]pyridine-3-carbonitrile Openeye Name: 1-[(4-fluorophenyl)methyl]-2-oxo-4-[4-(thiophene-2-carbonyl)piperazin-1-yl]thieno[3,4-b]pyridine-3-carbonitrile CAS Name: 1-[(4-fluorophenyl)methyl]-2-oxo-4-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]-3-thieno[3,4-b]pyridinecarbonitrile IUPAC Name: 1-[(4-fluorophenyl)methyl]-2-oxo-4-[4-(thiophene-2-carbonyl)piperazin-1-yl]thieno[3,4-b]pyridine-3-carbonitrile Traditional Name: 1-(4-fluorobenzyl)-2-keto-4-[4-(2-thenoyl)piperazino]thieno[3,4-b]pyridine-3-carbonitrile Formula: C24H19FN4O2S2 MolecularWeight: 478.561663

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C(=O)N(C3=CSC=C32)CC4=CC=C(C=C4)F)C#N)C(=O)C5=CC=CS5

Isomeric SMILES

C1CN(CCN1C2=C(C(=O)N(C3=CSC=C32)CC4=CC=C(C=C4)F)C#N)C(=O)C5=CC=CS5

InChI

InChI=1S/C24H19FN4O2S2/c25-17-5-3-16(4-6-17)13-29-20-15-32-14-19(20)22(18(12-26)23(29)30)27-7-9-28(10-8-27)24(31)21-2-1-11-33-21/h1-6,11,14-15H,7-10,13H2