[5-[4-[(6-chloranyl-1-benzothiophen-2-yl)sulfonyl]-3-piperazin-1-yl-pyridin-2-yl]-1H-pyrimidin-2-ylidene]methanone

Systemtic Name: [5-[4-[(6-chloranyl-1-benzothiophen-2-yl)sulfonyl]-3-piperazin-1-yl-pyridin-2-yl]-1H-pyrimidin-2-ylidene]methanone Openeye Name: [5-[4-(6-chlorobenzothiophen-2-yl)sulfonyl-3-piperazin-1-yl-2-pyridyl]-1H-pyrimidin-2-ylidene]methanone CAS Name: [5-[4-[(6-chloro-1-benzothiophen-2-yl)sulfonyl]-3-(1-piperazinyl)-2-pyridinyl]-1H-pyrimidin-2-ylidene]methanone IUPAC Name: [5-[4-[(6-chloro-1-benzothiophen-2-yl)sulfonyl]-3-piperazin-1-ylpyridin-2-yl]-1H-pyrimidin-2-ylidene]methanone Traditional Name: [5-[4-(6-chlorobenzothiophen-2-yl)sulfonyl-3-piperazino-2-pyridyl]-1H-pyrimidin-2-ylidene]methanone Formula: C22H18ClN5O3S2 MolecularWeight: 499.99302

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=C(C=CN=C2C3=CNC(=C=O)N=C3)S(=O)(=O)C4=CC5=C(S4)C=C(C=C5)Cl

Isomeric SMILES

C1CN(CCN1)C2=C(C=CN=C2C3=CNC(=C=O)N=C3)S(=O)(=O)C4=CC5=C(S4)C=C(C=C5)Cl

InChI

InChI=1S/C22H18ClN5O3S2/c23-16-2-1-14-9-20(32-17(14)10-16)33(30,31)18-3-4-25-21(15-11-26-19(13-29)27-12-15)22(18)28-7-5-24-6-8-28/h1-4,9-12,24,26H,5-8H2