4-(3-chloranylpyridin-2-yl)-N'-(4-cyclohexylphenyl)-N-oxidanyl-piperazine-1-carboximidamide

Systemtic Name: 4-(3-chloranylpyridin-2-yl)-N'-(4-cyclohexylphenyl)-N-oxidanyl-piperazine-1-carboximidamide Openeye Name: 4-(3-chloro-2-pyridyl)-N'-(4-cyclohexylphenyl)-N-hydroxy-piperazine-1-carboxamidine CAS Name: 4-(3-chloro-2-pyridinyl)-N'-(4-cyclohexylphenyl)-N-hydroxy-1-piperazinecarboximidamide IUPAC Name: 4-(3-chloropyridin-2-yl)-N'-(4-cyclohexylphenyl)-N-hydroxypiperazine-1-carboximidamide Traditional Name: 4-(3-chloro-2-pyridyl)-N'-(4-cyclohexylphenyl)-N-hydroxy-piperazine-1-carboxamidine Formula: C22H28ClN5O MolecularWeight: 413.94362

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)N=C(NO)N3CCN(CC3)C4=C(C=CC=N4)Cl

Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)N=C(NO)N3CCN(CC3)C4=C(C=CC=N4)Cl

InChI

InChI=1S/C22H28ClN5O/c23-20-7-4-12-24-21(20)27-13-15-28(16-14-27)22(26-29)25-19-10-8-18(9-11-19)17-5-2-1-3-6-17/h4,7-12,17,29H,1-3,5-6,13-16H2,(H,25,26)