1-[3-[(7-chloranylquinolin-4-yl)amino]propyl]-3-(4-methoxyphenyl)thiourea

Systemtic Name: 1-[3-[(7-chloranylquinolin-4-yl)amino]propyl]-3-(4-methoxyphenyl)thiourea Openeye Name: 1-[3-[(7-chloro-4-quinolyl)amino]propyl]-3-(4-methoxyphenyl)thiourea CAS Name: 1-[3-[(7-chloro-4-quinolinyl)amino]propyl]-3-(4-methoxyphenyl)thiourea IUPAC Name: 1-[3-[(7-chloroquinolin-4-yl)amino]propyl]-3-(4-methoxyphenyl)thiourea Traditional Name: 1-[3-[(7-chloro-4-quinolyl)amino]propyl]-3-(4-methoxyphenyl)thiourea Formula: C20H21ClN4OS MolecularWeight: 400.92494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=S)NCCCNC2=C3C=CC(=CC3=NC=C2)Cl

Isomeric SMILES

COC1=CC=C(C=C1)NC(=S)NCCCNC2=C3C=CC(=CC3=NC=C2)Cl

InChI

InChI=1S/C20H21ClN4OS/c1-26-16-6-4-15(5-7-16)25-20(27)24-11-2-10-22-18-9-12-23-19-13-14(21)3-8-17(18)19/h3-9,12-13H,2,10-11H2,1H3,(H,22,23)(H2,24,25,27)