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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=C(C=CN=C2C3=NC=CC(=C=O)N3)S(=O)(=O)C4=CC5=C(S4)C=C(C=C5)Cl

Isomeric SMILES

C1CN(CCN1)C2=C(C=CN=C2C3=NC=CC(=C=O)N3)S(=O)(=O)C4=CC5=C(S4)C=C(C=C5)Cl

InChI

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