N-[2-[3-[(4-cyanophenyl)methyl]imidazol-4-yl]ethyl]-4-(3-cyanophenyl)sulfonyl-1-methylsulfonyl-piperazine-2-carboxamide

Systemtic Name: N-[2-[3-[(4-cyanophenyl)methyl]imidazol-4-yl]ethyl]-4-(3-cyanophenyl)sulfonyl-1-methylsulfonyl-piperazine-2-carboxamide Openeye Name: N-[2-[3-[(4-cyanophenyl)methyl]imidazol-4-yl]ethyl]-4-(3-cyanophenyl)sulfonyl-1-methylsulfonyl-piperazine-2-carboxamide CAS Name: N-[2-[3-[(4-cyanophenyl)methyl]-4-imidazolyl]ethyl]-4-(3-cyanophenyl)sulfonyl-1-methylsulfonyl-2-piperazinecarboxamide IUPAC Name: N-[2-[3-[(4-cyanophenyl)methyl]imidazol-4-yl]ethyl]-4-(3-cyanophenyl)sulfonyl-1-methylsulfonylpiperazine-2-carboxamide Traditional Name: N-[2-[3-(4-cyanobenzyl)imidazol-4-yl]ethyl]-4-(3-cyanophenyl)sulfonyl-1-mesyl-piperazine-2-carboxamide Formula: C26H27N7O5S2 MolecularWeight: 581.66648

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1C(=O)NCCC2=CN=CN2CC3=CC=C(C=C3)C#N)S(=O)(=O)C4=CC=CC(=C4)C#N

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1C(=O)NCCC2=CN=CN2CC3=CC=C(C=C3)C#N)S(=O)(=O)C4=CC=CC(=C4)C#N

InChI

InChI=1S/C26H27N7O5S2/c1-39(35,36)33-12-11-32(40(37,38)24-4-2-3-22(13-24)15-28)18-25(33)26(34)30-10-9-23-16-29-19-31(23)17-21-7-5-20(14-27)6-8-21/h2-8,13,16,19,25H,9-12,17-18H2,1H3,(H,30,34)