N-[4-[(E)-3-[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]-3-oxidanylidene-prop-1-enyl]phenyl]ethanamide

Systemtic Name: N-[4-[(E)-3-[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]-3-oxidanylidene-prop-1-enyl]phenyl]ethanamide Openeye Name: N-[4-[(E)-3-[4-[(5-bromo-2-thienyl)sulfonyl]piperazin-1-yl]-3-oxo-prop-1-enyl]phenyl]acetamide CAS Name: N-[4-[(E)-3-[4-[(5-bromo-2-thiophenyl)sulfonyl]-1-piperazinyl]-3-oxoprop-1-enyl]phenyl]acetamide IUPAC Name: N-[4-[(E)-3-[4-(5-bromothiophen-2-yl)sulfonylpiperazin-1-yl]-3-oxoprop-1-enyl]phenyl]acetamide Traditional Name: N-[4-[(E)-3-[4-[(5-bromo-2-thienyl)sulfonyl]piperazino]-3-keto-prop-1-enyl]phenyl]acetamide Formula: C19H20BrN3O4S2 MolecularWeight: 498.4138

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C=CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Br

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)/C=C/C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Br

InChI

InChI=1S/C19H20BrN3O4S2/c1-14(24)21-16-5-2-15(3-6-16)4-8-18(25)22-10-12-23(13-11-22)29(26,27)19-9-7-17(20)28-19/h2-9H,10-13H2,1H3,(H,21,24)/b8-4+