4-(5-chloranylpyrimidin-4-yl)-N'-(4-cyclohexylphenyl)-N-oxidanyl-piperazine-1-carboximidamide

Systemtic Name: 4-(5-chloranylpyrimidin-4-yl)-N'-(4-cyclohexylphenyl)-N-oxidanyl-piperazine-1-carboximidamide Openeye Name: 4-(5-chloropyrimidin-4-yl)-N'-(4-cyclohexylphenyl)-N-hydroxy-piperazine-1-carboxamidine CAS Name: 4-(5-chloro-4-pyrimidinyl)-N'-(4-cyclohexylphenyl)-N-hydroxy-1-piperazinecarboximidamide IUPAC Name: 4-(5-chloropyrimidin-4-yl)-N'-(4-cyclohexylphenyl)-N-hydroxypiperazine-1-carboximidamide Traditional Name: 4-(5-chloropyrimidin-4-yl)-N'-(4-cyclohexylphenyl)-N-hydroxy-piperazine-1-carboxamidine Formula: C21H27ClN6O MolecularWeight: 414.93168

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)N=C(NO)N3CCN(CC3)C4=NC=NC=C4Cl

Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)N=C(NO)N3CCN(CC3)C4=NC=NC=C4Cl

InChI

InChI=1S/C21H27ClN6O/c22-19-14-23-15-24-20(19)27-10-12-28(13-11-27)21(26-29)25-18-8-6-17(7-9-18)16-4-2-1-3-5-16/h6-9,14-16,29H,1-5,10-13H2,(H,25,26)