N4-(1,3-benzothiazol-2-yl)-N1-(7-chloranylquinolin-4-yl)cyclohexane-1,4-diamine

Systemtic Name: N4-(1,3-benzothiazol-2-yl)-N1-(7-chloranylquinolin-4-yl)cyclohexane-1,4-diamine Openeye Name: N4-(1,3-benzothiazol-2-yl)-N1-(7-chloro-4-quinolyl)cyclohexane-1,4-diamine CAS Name: N4-(1,3-benzothiazol-2-yl)-N1-(7-chloro-4-quinolinyl)cyclohexane-1,4-diamine IUPAC Name: 4-N-(1,3-benzothiazol-2-yl)-1-N-(7-chloroquinolin-4-yl)cyclohexane-1,4-diamine Traditional Name: 1,3-benzothiazol-2-yl-[4-[(7-chloro-4-quinolyl)amino]cyclohexyl]amine Formula: C22H21ClN4S MolecularWeight: 408.94694

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1NC2=C3C=CC(=CC3=NC=C2)Cl)NC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CC(CCC1NC2=C3C=CC(=CC3=NC=C2)Cl)NC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C22H21ClN4S/c23-14-5-10-17-18(11-12-24-20(17)13-14)25-15-6-8-16(9-7-15)26-22-27-19-3-1-2-4-21(19)28-22/h1-5,10-13,15-16H,6-9H2,(H,24,25)(H,26,27)