2-[2-[(4-methoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-[4-(4-methylsulfonylpiperazin-1-yl)phenyl]ethanamide

Systemtic Name: 2-[2-[(4-methoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-[4-(4-methylsulfonylpiperazin-1-yl)phenyl]ethanamide Openeye Name: 2-[2-(4-methoxyanilino)-2-oxo-ethyl]sulfanyl-N-[4-(4-methylsulfonylpiperazin-1-yl)phenyl]acetamide CAS Name: 2-[[2-(4-methoxyanilino)-2-oxoethyl]thio]-N-[4-(4-methylsulfonyl-1-piperazinyl)phenyl]acetamide IUPAC Name: 2-[2-(4-methoxyanilino)-2-oxoethyl]sulfanyl-N-[4-(4-methylsulfonylpiperazin-1-yl)phenyl]acetamide Traditional Name: 2-[[2-keto-2-(p-anisidino)ethyl]thio]-N-[4-(4-mesylpiperazino)phenyl]acetamide Formula: C22H28N4O5S2 MolecularWeight: 492.61152

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)CSCC(=O)NC2=CC=C(C=C2)N3CCN(CC3)S(=O)(=O)C

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)CSCC(=O)NC2=CC=C(C=C2)N3CCN(CC3)S(=O)(=O)C

InChI

InChI=1S/C22H28N4O5S2/c1-31-20-9-5-18(6-10-20)24-22(28)16-32-15-21(27)23-17-3-7-19(8-4-17)25-11-13-26(14-12-25)33(2,29)30/h3-10H,11-16H2,1-2H3,(H,23,27)(H,24,28)