2-[4-[(6-chloranyl-1-benzothiophen-2-yl)sulfonyl]-2-oxidanylidene-piperazin-1-yl]-N-pyrimidin-4-yl-ethanamide

Systemtic Name: 2-[4-[(6-chloranyl-1-benzothiophen-2-yl)sulfonyl]-2-oxidanylidene-piperazin-1-yl]-N-pyrimidin-4-yl-ethanamide Openeye Name: 2-[4-(6-chlorobenzothiophen-2-yl)sulfonyl-2-oxo-piperazin-1-yl]-N-pyrimidin-4-yl-acetamide CAS Name: 2-[4-[(6-chloro-1-benzothiophen-2-yl)sulfonyl]-2-oxo-1-piperazinyl]-N-(4-pyrimidinyl)acetamide IUPAC Name: 2-[4-[(6-chloro-1-benzothiophen-2-yl)sulfonyl]-2-oxopiperazin-1-yl]-N-pyrimidin-4-ylacetamide Traditional Name: 2-[4-(6-chlorobenzothiophen-2-yl)sulfonyl-2-keto-piperazino]-N-(4-pyrimidyl)acetamide Formula: C18H16ClN5O4S2 MolecularWeight: 465.93374

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)CN1S(=O)(=O)C2=CC3=C(S2)C=C(C=C3)Cl)CC(=O)NC4=NC=NC=C4

Isomeric SMILES

C1CN(C(=O)CN1S(=O)(=O)C2=CC3=C(S2)C=C(C=C3)Cl)CC(=O)NC4=NC=NC=C4

InChI

InChI=1S/C18H16ClN5O4S2/c19-13-2-1-12-7-18(29-14(12)8-13)30(27,28)24-6-5-23(17(26)10-24)9-16(25)22-15-3-4-20-11-21-15/h1-4,7-8,11H,5-6,9-10H2,(H,20,21,22,25)