1-[1-(6-chloranylquinolin-4-yl)piperidin-4-yl]-3-(3-methoxyphenyl)thiourea

Systemtic Name: 1-[1-(6-chloranylquinolin-4-yl)piperidin-4-yl]-3-(3-methoxyphenyl)thiourea Openeye Name: 1-[1-(6-chloro-4-quinolyl)-4-piperidyl]-3-(3-methoxyphenyl)thiourea CAS Name: 1-[1-(6-chloro-4-quinolinyl)-4-piperidinyl]-3-(3-methoxyphenyl)thiourea IUPAC Name: 1-[1-(6-chloroquinolin-4-yl)piperidin-4-yl]-3-(3-methoxyphenyl)thiourea Traditional Name: 1-[1-(6-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=C(C=CC4=NC=C3)Cl

Isomeric SMILES

COC1=CC=CC(=C1)NC(=S)NC2CCN(CC2)C3=C4C=C(C=CC4=NC=C3)Cl

InChI

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