1-[1-(8-chloranylquinolin-4-yl)piperidin-4-yl]-3-(3-methoxyphenyl)thiourea

Systemtic Name: 1-[1-(8-chloranylquinolin-4-yl)piperidin-4-yl]-3-(3-methoxyphenyl)thiourea Openeye Name: 1-[1-(8-chloro-4-quinolyl)-4-piperidyl]-3-(3-methoxyphenyl)thiourea CAS Name: 1-[1-(8-chloro-4-quinolinyl)-4-piperidinyl]-3-(3-methoxyphenyl)thiourea IUPAC Name: 1-[1-(8-chloroquinolin-4-yl)piperidin-4-yl]-3-(3-methoxyphenyl)thiourea Traditional Name: 1-[1-(8-chloro-4-quinolyl)-4-piperidyl]-3-(3-methoxyphenyl)thiourea Formula: C22H23ClN4OS MolecularWeight: 426.96222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=S)NC2CCN(CC2)C3=C4C=CC=C(C4=NC=C3)Cl

Isomeric SMILES

COC1=CC=CC(=C1)NC(=S)NC2CCN(CC2)C3=C4C=CC=C(C4=NC=C3)Cl

InChI

InChI=1S/C22H23ClN4OS/c1-28-17-5-2-4-16(14-17)26-22(29)25-15-9-12-27(13-10-15)20-8-11-24-21-18(20)6-3-7-19(21)23/h2-8,11,14-15H,9-10,12-13H2,1H3,(H2,25,26,29)