3-[4-[(5-ethynyl-1H-indol-2-yl)sulfonyl]-1-thieno[3,2-b]pyridin-2-ylcarbonyl-piperazin-2-yl]propanenitrile

Systemtic Name: 3-[4-[(5-ethynyl-1H-indol-2-yl)sulfonyl]-1-thieno[3,2-b]pyridin-2-ylcarbonyl-piperazin-2-yl]propanenitrile Openeye Name: 3-[4-[(5-ethynyl-1H-indol-2-yl)sulfonyl]-1-(thieno[3,2-b]pyridine-2-carbonyl)piperazin-2-yl]propanenitrile CAS Name: 3-[4-[(5-ethynyl-1H-indol-2-yl)sulfonyl]-1-[oxo(2-thieno[3,2-b]pyridinyl)methyl]-2-piperazinyl]propanenitrile IUPAC Name: 3-[4-[(5-ethynyl-1H-indol-2-yl)sulfonyl]-1-(thieno[3,2-b]pyridine-2-carbonyl)piperazin-2-yl]propanenitrile Traditional Name: 3-[4-[(5-ethynyl-1H-indol-2-yl)sulfonyl]-1-(thieno[3,2-b]pyridine-2-carbonyl)piperazin-2-yl]propionitrile Formula: C25H21N5O3S2 MolecularWeight: 503.59594

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC2=C(C=C1)NC(=C2)S(=O)(=O)N3CCN(C(C3)CCC#N)C(=O)C4=CC5=C(S4)C=CC=N5

Isomeric SMILES

C#CC1=CC2=C(C=C1)NC(=C2)S(=O)(=O)N3CCN(C(C3)CCC#N)C(=O)C4=CC5=C(S4)C=CC=N5

InChI

InChI=1S/C25H21N5O3S2/c1-2-17-7-8-20-18(13-17)14-24(28-20)35(32,33)29-11-12-30(19(16-29)5-3-9-26)25(31)23-15-21-22(34-23)6-4-10-27-21/h1,4,6-8,10,13-15,19,28H,3,5,11-12,16H2