N-(6-azanylpyridin-3-yl)-4-[3-(2-cyclohexylethoxy)phenyl]carbonyl-piperazine-1-carboxamide

Systemtic Name: N-(6-azanylpyridin-3-yl)-4-[3-(2-cyclohexylethoxy)phenyl]carbonyl-piperazine-1-carboxamide Openeye Name: N-(6-amino-3-pyridyl)-4-[3-(2-cyclohexylethoxy)benzoyl]piperazine-1-carboxamide CAS Name: N-(6-amino-3-pyridinyl)-4-[[3-(2-cyclohexylethoxy)phenyl]-oxomethyl]-1-piperazinecarboxamide IUPAC Name: N-(6-aminopyridin-3-yl)-4-[3-(2-cyclohexylethoxy)benzoyl]piperazine-1-carboxamide Traditional Name: N-(6-amino-3-pyridyl)-4-[3-(2-cyclohexylethoxy)benzoyl]piperazine-1-carboxamide Formula: C25H33N5O3 MolecularWeight: 451.56122

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCOC2=CC=CC(=C2)C(=O)N3CCN(CC3)C(=O)NC4=CN=C(C=C4)N

Isomeric SMILES

C1CCC(CC1)CCOC2=CC=CC(=C2)C(=O)N3CCN(CC3)C(=O)NC4=CN=C(C=C4)N

InChI

InChI=1S/C25H33N5O3/c26-23-10-9-21(18-27-23)28-25(32)30-14-12-29(13-15-30)24(31)20-7-4-8-22(17-20)33-16-11-19-5-2-1-3-6-19/h4,7-10,17-19H,1-3,5-6,11-16H2,(H2,26,27)(H,28,32)