2-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-N-[(E)-(4-methoxy-3-phenylmethoxy-phenyl)methylideneamino]ethanamide

Systemtic Name: 2-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-N-[(E)-(4-methoxy-3-phenylmethoxy-phenyl)methylideneamino]ethanamide Openeye Name: N-[(E)-(3-benzyloxy-4-methoxy-phenyl)methyleneamino]-2-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]acetamide CAS Name: 2-[4-(4-bromophenyl)sulfonyl-1-piperazinyl]-N-[(E)-(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]acetamide IUPAC Name: 2-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-N-[(E)-(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]acetamide Traditional Name: N-[(E)-(3-benzoxy-4-methoxy-benzylidene)amino]-2-(4-brosylpiperazino)acetamide Formula: C27H29BrN4O5S MolecularWeight: 601.51196

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=NNC(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Br)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=C(C=C1)/C=N/NC(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Br)OCC4=CC=CC=C4

InChI

InChI=1S/C27H29BrN4O5S/c1-36-25-12-7-22(17-26(25)37-20-21-5-3-2-4-6-21)18-29-30-27(33)19-31-13-15-32(16-14-31)38(34,35)24-10-8-23(28)9-11-24/h2-12,17-18H,13-16,19-20H2,1H3,(H,30,33)/b29-18+