(E)-1-[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]-3-(3-nitrophenyl)prop-2-en-1-one

Systemtic Name: (E)-1-[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]-3-(3-nitrophenyl)prop-2-en-1-one Openeye Name: (E)-1-[4-[(5-bromo-2-thienyl)sulfonyl]piperazin-1-yl]-3-(3-nitrophenyl)prop-2-en-1-one CAS Name: (E)-1-[4-[(5-bromo-2-thiophenyl)sulfonyl]-1-piperazinyl]-3-(3-nitrophenyl)-2-propen-1-one IUPAC Name: (E)-1-[4-(5-bromothiophen-2-yl)sulfonylpiperazin-1-yl]-3-(3-nitrophenyl)prop-2-en-1-one Traditional Name: (E)-1-[4-[(5-bromo-2-thienyl)sulfonyl]piperazino]-3-(3-nitrophenyl)prop-2-en-1-one Formula: C17H16BrN3O5S2 MolecularWeight: 486.36004

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C=CC2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=C(S3)Br

Isomeric SMILES

C1CN(CCN1C(=O)/C=C/C2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=C(S3)Br

InChI

InChI=1S/C17H16BrN3O5S2/c18-15-5-7-17(27-15)28(25,26)20-10-8-19(9-11-20)16(22)6-4-13-2-1-3-14(12-13)21(23)24/h1-7,12H,8-11H2/b6-4+