N2-[(2-chloranylquinolin-3-yl)methyl]-N1,N1-dimethyl-4-piperidin-1-ylsulfonyl-benzene-1,2-diamine

Systemtic Name: N2-[(2-chloranylquinolin-3-yl)methyl]-N1,N1-dimethyl-4-piperidin-1-ylsulfonyl-benzene-1,2-diamine Openeye Name: N2-[(2-chloro-3-quinolyl)methyl]-N1,N1-dimethyl-4-(1-piperidylsulfonyl)benzene-1,2-diamine CAS Name: N2-[(2-chloro-3-quinolinyl)methyl]-N1,N1-dimethyl-4-(1-piperidinylsulfonyl)benzene-1,2-diamine IUPAC Name: 2-N-[(2-chloroquinolin-3-yl)methyl]-1-N,1-N-dimethyl-4-piperidin-1-ylsulfonylbenzene-1,2-diamine Traditional Name: [2-[(2-chloro-3-quinolyl)methylamino]-4-piperidinosulfonyl-phenyl]-dimethyl-amine Formula: C23H27ClN4O2S MolecularWeight: 459.00408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NCC3=CC4=CC=CC=C4N=C3Cl

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NCC3=CC4=CC=CC=C4N=C3Cl

InChI

InChI=1S/C23H27ClN4O2S/c1-27(2)22-11-10-19(31(29,30)28-12-6-3-7-13-28)15-21(22)25-16-18-14-17-8-4-5-9-20(17)26-23(18)24/h4-5,8-11,14-15,25H,3,6-7,12-13,16H2,1-2H3