[4-[(6-chloranyl-1-benzothiophen-2-yl)sulfonyl]piperazin-1-yl]-(5-pyridin-4-ylpyrimidin-2-yl)methanone

Systemtic Name: [4-[(6-chloranyl-1-benzothiophen-2-yl)sulfonyl]piperazin-1-yl]-(5-pyridin-4-ylpyrimidin-2-yl)methanone Openeye Name: [4-(6-chlorobenzothiophen-2-yl)sulfonylpiperazin-1-yl]-[5-(4-pyridyl)pyrimidin-2-yl]methanone CAS Name: [4-[(6-chloro-1-benzothiophen-2-yl)sulfonyl]-1-piperazinyl]-(5-pyridin-4-yl-2-pyrimidinyl)methanone IUPAC Name: [4-[(6-chloro-1-benzothiophen-2-yl)sulfonyl]piperazin-1-yl]-(5-pyridin-4-ylpyrimidin-2-yl)methanone Traditional Name: [4-(6-chlorobenzothiophen-2-yl)sulfonylpiperazino]-[5-(4-pyridyl)pyrimidin-2-yl]methanone Formula: C22H18ClN5O3S2 MolecularWeight: 499.99302

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=NC=C(C=N2)C3=CC=NC=C3)S(=O)(=O)C4=CC5=C(S4)C=C(C=C5)Cl

Isomeric SMILES

C1CN(CCN1C(=O)C2=NC=C(C=N2)C3=CC=NC=C3)S(=O)(=O)C4=CC5=C(S4)C=C(C=C5)Cl

InChI

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