N-[(E)-(5-bromanyl-2-methoxy-phenyl)methylideneamino]-2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]ethanamide

Systemtic Name: N-[(E)-(5-bromanyl-2-methoxy-phenyl)methylideneamino]-2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]ethanamide Openeye Name: N-[(E)-(5-bromo-2-methoxy-phenyl)methyleneamino]-2-[4-(p-tolylsulfonyl)piperazin-1-yl]acetamide CAS Name: N-[(E)-(5-bromo-2-methoxyphenyl)methylideneamino]-2-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]acetamide IUPAC Name: N-[(E)-(5-bromo-2-methoxyphenyl)methylideneamino]-2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]acetamide Traditional Name: N-[(E)-(5-bromo-2-methoxy-benzylidene)amino]-2-(4-tosylpiperazino)acetamide Formula: C21H25BrN4O4S MolecularWeight: 509.4166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NN=CC3=C(C=CC(=C3)Br)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)N/N=C/C3=C(C=CC(=C3)Br)OC

InChI

InChI=1S/C21H25BrN4O4S/c1-16-3-6-19(7-4-16)31(28,29)26-11-9-25(10-12-26)15-21(27)24-23-14-17-13-18(22)5-8-20(17)30-2/h3-8,13-14H,9-12,15H2,1-2H3,(H,24,27)/b23-14+