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

Systemtic Name: N-[2-[3-[(4-cyanophenyl)methyl]imidazol-4-yl]ethyl]-4-methyl-1-methylsulfonyl-piperazine-2-carboxamide Openeye Name: N-[2-[3-[(4-cyanophenyl)methyl]imidazol-4-yl]ethyl]-4-methyl-1-methylsulfonyl-piperazine-2-carboxamide CAS Name: N-[2-[3-[(4-cyanophenyl)methyl]-4-imidazolyl]ethyl]-4-methyl-1-methylsulfonyl-2-piperazinecarboxamide IUPAC Name: N-[2-[3-[(4-cyanophenyl)methyl]imidazol-4-yl]ethyl]-4-methyl-1-methylsulfonylpiperazine-2-carboxamide Traditional Name: N-[2-[3-(4-cyanobenzyl)imidazol-4-yl]ethyl]-1-mesyl-4-methyl-piperazine-2-carboxamide Formula: C20H26N6O3S MolecularWeight: 430.52384

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(C(C1)C(=O)NCCC2=CN=CN2CC3=CC=C(C=C3)C#N)S(=O)(=O)C

Isomeric SMILES

CN1CCN(C(C1)C(=O)NCCC2=CN=CN2CC3=CC=C(C=C3)C#N)S(=O)(=O)C

InChI

InChI=1S/C20H26N6O3S/c1-24-9-10-26(30(2,28)29)19(14-24)20(27)23-8-7-18-12-22-15-25(18)13-17-5-3-16(11-21)4-6-17/h3-6,12,15,19H,7-10,13-14H2,1-2H3,(H,23,27)