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

Systemtic Name: 1-(3-bromophenyl)-3-[1-(6-chloranylquinolin-4-yl)piperidin-4-yl]thiourea Openeye Name: 1-(3-bromophenyl)-3-[1-(6-chloro-4-quinolyl)-4-piperidyl]thiourea CAS Name: 1-(3-bromophenyl)-3-[1-(6-chloro-4-quinolinyl)-4-piperidinyl]thiourea IUPAC Name: 1-(3-bromophenyl)-3-[1-(6-chloroquinolin-4-yl)piperidin-4-yl]thiourea Traditional Name: 1-(3-bromophenyl)-3-[1-(6-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=C2)Br)C3=C4C=C(C=CC4=NC=C3)Cl

Isomeric SMILES

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

InChI

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