2-[4-[5-(4-methoxyphenyl)thieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 2-[4-[5-(4-methoxyphenyl)thieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[4-[5-(4-methoxyphenyl)thieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl]sulfonylbenzonitrile CAS Name: 2-[[4-[5-(4-methoxyphenyl)-4-thieno[2,3-d]pyrimidinyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-[5-(4-methoxyphenyl)thieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-[5-(4-methoxyphenyl)thieno[2,3-d]pyrimidin-4-yl]piperazino]sulfonylbenzonitrile Formula: C24H21N5O3S2 MolecularWeight: 491.58524

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CSC3=NC=NC(=C23)N4CCN(CC4)S(=O)(=O)C5=CC=CC=C5C#N

Isomeric SMILES

COC1=CC=C(C=C1)C2=CSC3=NC=NC(=C23)N4CCN(CC4)S(=O)(=O)C5=CC=CC=C5C#N

InChI

InChI=1S/C24H21N5O3S2/c1-32-19-8-6-17(7-9-19)20-15-33-24-22(20)23(26-16-27-24)28-10-12-29(13-11-28)34(30,31)21-5-3-2-4-18(21)14-25/h2-9,15-16H,10-13H2,1H3