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

Systemtic Name: N-[(E)-(5-bromanylthiophen-2-yl)methylideneamino]-2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]ethanamide Openeye Name: N-[(E)-(5-bromo-2-thienyl)methyleneamino]-2-[4-(p-tolylsulfonyl)piperazin-1-yl]acetamide CAS Name: N-[(E)-(5-bromo-2-thiophenyl)methylideneamino]-2-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]acetamide IUPAC Name: N-[(E)-(5-bromothiophen-2-yl)methylideneamino]-2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]acetamide Traditional Name: N-[(E)-(5-bromo-2-thienyl)methyleneamino]-2-(4-tosylpiperazino)acetamide Formula: C18H21BrN4O3S2 MolecularWeight: 485.41834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NN=CC3=CC=C(S3)Br

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)N/N=C/C3=CC=C(S3)Br

InChI

InChI=1S/C18H21BrN4O3S2/c1-14-2-5-16(6-3-14)28(25,26)23-10-8-22(9-11-23)13-18(24)21-20-12-15-4-7-17(19)27-15/h2-7,12H,8-11,13H2,1H3,(H,21,24)/b20-12+