N-(7-chloranylquinolin-4-yl)-N'-propyl-N'-(thiophen-2-ylmethyl)butane-1,4-diamine

Systemtic Name: N-(7-chloranylquinolin-4-yl)-N'-propyl-N'-(thiophen-2-ylmethyl)butane-1,4-diamine Openeye Name: N-(7-chloro-4-quinolyl)-N'-propyl-N'-(2-thienylmethyl)butane-1,4-diamine CAS Name: N-(7-chloro-4-quinolinyl)-N'-propyl-N'-(thiophen-2-ylmethyl)butane-1,4-diamine IUPAC Name: N-(7-chloroquinolin-4-yl)-N'-propyl-N'-(thiophen-2-ylmethyl)butane-1,4-diamine Traditional Name: 4-[(7-chloro-4-quinolyl)amino]butyl-propyl-(2-thenyl)amine Formula: C21H26ClN3S MolecularWeight: 387.96924

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCCCNC1=C2C=CC(=CC2=NC=C1)Cl)CC3=CC=CS3

Isomeric SMILES

CCCN(CCCCNC1=C2C=CC(=CC2=NC=C1)Cl)CC3=CC=CS3

InChI

InChI=1S/C21H26ClN3S/c1-2-12-25(16-18-6-5-14-26-18)13-4-3-10-23-20-9-11-24-21-15-17(22)7-8-19(20)21/h5-9,11,14-15H,2-4,10,12-13,16H2,1H3,(H,23,24)