N-[2-[(3S)-3-azanylpiperidin-1-yl]-6-chloranyl-quinolin-5-yl]-2-cyclohexyl-ethanamide

Systemtic Name: N-[2-[(3S)-3-azanylpiperidin-1-yl]-6-chloranyl-quinolin-5-yl]-2-cyclohexyl-ethanamide Openeye Name: N-[2-[(3S)-3-amino-1-piperidyl]-6-chloro-5-quinolyl]-2-cyclohexyl-acetamide CAS Name: N-[2-[(3S)-3-amino-1-piperidinyl]-6-chloro-5-quinolinyl]-2-cyclohexylacetamide IUPAC Name: N-[2-[(3S)-3-aminopiperidin-1-yl]-6-chloroquinolin-5-yl]-2-cyclohexylacetamide Traditional Name: N-[2-[(3S)-3-aminopiperidino]-6-chloro-5-quinolyl]-2-cyclohexyl-acetamide Formula: C22H29ClN4O MolecularWeight: 400.94486

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(=O)NC2=C(C=CC3=C2C=CC(=N3)N4CCCC(C4)N)Cl

Isomeric SMILES

C1CCC(CC1)CC(=O)NC2=C(C=CC3=C2C=CC(=N3)N4CCC[C@@H](C4)N)Cl

InChI

InChI=1S/C22H29ClN4O/c23-18-9-10-19-17(8-11-20(25-19)27-12-4-7-16(24)14-27)22(18)26-21(28)13-15-5-2-1-3-6-15/h8-11,15-16H,1-7,12-14,24H2,(H,26,28)/t16-/m0/s1