1-(2-bromophenyl)-3-[1-(7-chloranylquinolin-4-yl)piperidin-4-yl]thiourea

Systemtic Name: 1-(2-bromophenyl)-3-[1-(7-chloranylquinolin-4-yl)piperidin-4-yl]thiourea Openeye Name: 1-(2-bromophenyl)-3-[1-(7-chloro-4-quinolyl)-4-piperidyl]thiourea CAS Name: 1-(2-bromophenyl)-3-[1-(7-chloro-4-quinolinyl)-4-piperidinyl]thiourea IUPAC Name: 1-(2-bromophenyl)-3-[1-(7-chloroquinolin-4-yl)piperidin-4-yl]thiourea Traditional Name: 1-(2-bromophenyl)-3-[1-(7-chloro-4-quinolyl)-4-piperidyl]thiourea Formula: C21H20BrClN4S MolecularWeight: 475.8323

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=S)NC2=CC=CC=C2Br)C3=C4C=CC(=CC4=NC=C3)Cl

Isomeric SMILES

C1CN(CCC1NC(=S)NC2=CC=CC=C2Br)C3=C4C=CC(=CC4=NC=C3)Cl

InChI

InChI=1S/C21H20BrClN4S/c22-17-3-1-2-4-18(17)26-21(28)25-15-8-11-27(12-9-15)20-7-10-24-19-13-14(23)5-6-16(19)20/h1-7,10,13,15H,8-9,11-12H2,(H2,25,26,28)