N-[1-(cyanomethylcarbamoyl)cyclohexyl]-4-piperazin-1-yl-benzamide

Systemtic Name: N-[1-(cyanomethylcarbamoyl)cyclohexyl]-4-piperazin-1-yl-benzamide Openeye Name: N-[1-(cyanomethylcarbamoyl)cyclohexyl]-4-piperazin-1-yl-benzamide CAS Name: N-[1-[(cyanomethylamino)-oxomethyl]cyclohexyl]-4-(1-piperazinyl)benzamide IUPAC Name: N-[1-(cyanomethylcarbamoyl)cyclohexyl]-4-piperazin-1-ylbenzamide Traditional Name: N-[1-(cyanomethylcarbamoyl)cyclohexyl]-4-piperazino-benzamide Formula: C20H27N5O2 MolecularWeight: 369.46068

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C(=O)NCC#N)NC(=O)C2=CC=C(C=C2)N3CCNCC3

Isomeric SMILES

C1CCC(CC1)(C(=O)NCC#N)NC(=O)C2=CC=C(C=C2)N3CCNCC3

InChI

InChI=1S/C20H27N5O2/c21-10-11-23-19(27)20(8-2-1-3-9-20)24-18(26)16-4-6-17(7-5-16)25-14-12-22-13-15-25/h4-7,22H,1-3,8-9,11-15H2,(H,23,27)(H,24,26)