1-[1-(7-chloranylquinolin-4-yl)piperidin-4-yl]-3-(3-cyanophenyl)thiourea

Systemtic Name: 1-[1-(7-chloranylquinolin-4-yl)piperidin-4-yl]-3-(3-cyanophenyl)thiourea Openeye Name: 1-[1-(7-chloro-4-quinolyl)-4-piperidyl]-3-(3-cyanophenyl)thiourea CAS Name: 1-[1-(7-chloro-4-quinolinyl)-4-piperidinyl]-3-(3-cyanophenyl)thiourea IUPAC Name: 1-[1-(7-chloroquinolin-4-yl)piperidin-4-yl]-3-(3-cyanophenyl)thiourea Traditional Name: 1-[1-(7-chloro-4-quinolyl)-4-piperidyl]-3-(3-cyanophenyl)thiourea Formula: C22H20ClN5S MolecularWeight: 421.9457

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=S)NC2=CC=CC(=C2)C#N)C3=C4C=CC(=CC4=NC=C3)Cl

Isomeric SMILES

C1CN(CCC1NC(=S)NC2=CC=CC(=C2)C#N)C3=C4C=CC(=CC4=NC=C3)Cl

InChI

InChI=1S/C22H20ClN5S/c23-16-4-5-19-20(13-16)25-9-6-21(19)28-10-7-17(8-11-28)26-22(29)27-18-3-1-2-15(12-18)14-24/h1-6,9,12-13,17H,7-8,10-11H2,(H2,26,27,29)