N-[6-chloranyl-2-[[(3R)-pyrrolidin-3-yl]amino]quinolin-5-yl]-2-cyclohexyl-ethanamide

Systemtic Name: N-[6-chloranyl-2-[[(3R)-pyrrolidin-3-yl]amino]quinolin-5-yl]-2-cyclohexyl-ethanamide Openeye Name: N-[6-chloro-2-[[(3R)-pyrrolidin-3-yl]amino]-5-quinolyl]-2-cyclohexyl-acetamide CAS Name: N-[6-chloro-2-[[(3R)-3-pyrrolidinyl]amino]-5-quinolinyl]-2-cyclohexylacetamide IUPAC Name: N-[6-chloro-2-[[(3R)-pyrrolidin-3-yl]amino]quinolin-5-yl]-2-cyclohexylacetamide Traditional Name: N-[6-chloro-2-[[(3R)-pyrrolidin-3-yl]amino]-5-quinolyl]-2-cyclohexyl-acetamide Formula: C21H27ClN4O MolecularWeight: 386.91828

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(=O)NC2=C(C=CC3=C2C=CC(=N3)NC4CCNC4)Cl

Isomeric SMILES

C1CCC(CC1)CC(=O)NC2=C(C=CC3=C2C=CC(=N3)N[C@@H]4CCNC4)Cl

InChI

InChI=1S/C21H27ClN4O/c22-17-7-8-18-16(6-9-19(25-18)24-15-10-11-23-13-15)21(17)26-20(27)12-14-4-2-1-3-5-14/h6-9,14-15,23H,1-5,10-13H2,(H,24,25)(H,26,27)/t15-/m1/s1