2-azanyl-1-[4-[2-[(7-chloranylquinolin-4-yl)amino]ethyl]piperazin-1-yl]-3-methyl-pentan-1-one

Systemtic Name: 2-azanyl-1-[4-[2-[(7-chloranylquinolin-4-yl)amino]ethyl]piperazin-1-yl]-3-methyl-pentan-1-one Openeye Name: 2-amino-1-[4-[2-[(7-chloro-4-quinolyl)amino]ethyl]piperazin-1-yl]-3-methyl-pentan-1-one CAS Name: 2-amino-1-[4-[2-[(7-chloro-4-quinolinyl)amino]ethyl]-1-piperazinyl]-3-methyl-1-pentanone IUPAC Name: 2-amino-1-[4-[2-[(7-chloroquinolin-4-yl)amino]ethyl]piperazin-1-yl]-3-methylpentan-1-one Traditional Name: 2-amino-1-[4-[2-[(7-chloro-4-quinolyl)amino]ethyl]piperazino]-3-methyl-pentan-1-one Formula: C21H30ClN5O MolecularWeight: 403.9488

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)N1CCN(CC1)CCNC2=C3C=CC(=CC3=NC=C2)Cl)N

Isomeric SMILES

CCC(C)C(C(=O)N1CCN(CC1)CCNC2=C3C=CC(=CC3=NC=C2)Cl)N

InChI

InChI=1S/C21H30ClN5O/c1-3-15(2)20(23)21(28)27-12-10-26(11-13-27)9-8-25-18-6-7-24-19-14-16(22)4-5-17(18)19/h4-7,14-15,20H,3,8-13,23H2,1-2H3,(H,24,25)