1-[2-[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]pyrimidin-2-one

Systemtic Name: 1-[2-[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]pyrimidin-2-one Openeye Name: 1-[2-[4-[(5-bromo-2-thienyl)sulfonyl]piperazin-1-yl]-2-oxo-ethyl]pyrimidin-2-one CAS Name: 1-[2-[4-[(5-bromo-2-thiophenyl)sulfonyl]-1-piperazinyl]-2-oxoethyl]-2-pyrimidinone IUPAC Name: 1-[2-[4-(5-bromothiophen-2-yl)sulfonylpiperazin-1-yl]-2-oxoethyl]pyrimidin-2-one Traditional Name: 1-[2-[4-[(5-bromo-2-thienyl)sulfonyl]piperazino]-2-keto-ethyl]pyrimidin-2-one Formula: C14H15BrN4O4S2 MolecularWeight: 447.3273

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CN2C=CC=NC2=O)S(=O)(=O)C3=CC=C(S3)Br

Isomeric SMILES

C1CN(CCN1C(=O)CN2C=CC=NC2=O)S(=O)(=O)C3=CC=C(S3)Br

InChI

InChI=1S/C14H15BrN4O4S2/c15-11-2-3-13(24-11)25(22,23)19-8-6-17(7-9-19)12(20)10-18-5-1-4-16-14(18)21/h1-5H,6-10H2