2-[4-[2-[1-(3-methoxyphenyl)imidazol-2-yl]sulfanylethanoyl]piperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 2-[4-[2-[1-(3-methoxyphenyl)imidazol-2-yl]sulfanylethanoyl]piperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[4-[2-[1-(3-methoxyphenyl)imidazol-2-yl]sulfanylacetyl]piperazin-1-yl]sulfonylbenzonitrile CAS Name: 2-[[4-[2-[[1-(3-methoxyphenyl)-2-imidazolyl]thio]-1-oxoethyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-[2-[1-(3-methoxyphenyl)imidazol-2-yl]sulfanylacetyl]piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-[2-[[1-(3-methoxyphenyl)imidazol-2-yl]thio]acetyl]piperazino]sulfonylbenzonitrile Formula: C23H23N5O4S2 MolecularWeight: 497.58982

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2C=CN=C2SCC(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4C#N

Isomeric SMILES

COC1=CC=CC(=C1)N2C=CN=C2SCC(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4C#N

InChI

InChI=1S/C23H23N5O4S2/c1-32-20-7-4-6-19(15-20)28-10-9-25-23(28)33-17-22(29)26-11-13-27(14-12-26)34(30,31)21-8-3-2-5-18(21)16-24/h2-10,15H,11-14,17H2,1H3