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

Systemtic Name: 1-[1-(8-chloranylquinolin-4-yl)piperidin-4-yl]-3-phenyl-thiourea Openeye Name: 1-[1-(8-chloro-4-quinolyl)-4-piperidyl]-3-phenyl-thiourea CAS Name: 1-[1-(8-chloro-4-quinolinyl)-4-piperidinyl]-3-phenylthiourea IUPAC Name: 1-[1-(8-chloroquinolin-4-yl)piperidin-4-yl]-3-phenylthiourea Traditional Name: 1-[1-(8-chloro-4-quinolyl)-4-piperidyl]-3-phenyl-thiourea Formula: C21H21ClN4S MolecularWeight: 396.93624

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=S)NC2=CC=CC=C2)C3=C4C=CC=C(C4=NC=C3)Cl

Isomeric SMILES

C1CN(CCC1NC(=S)NC2=CC=CC=C2)C3=C4C=CC=C(C4=NC=C3)Cl

InChI

InChI=1S/C21H21ClN4S/c22-18-8-4-7-17-19(9-12-23-20(17)18)26-13-10-16(11-14-26)25-21(27)24-15-5-2-1-3-6-15/h1-9,12,16H,10-11,13-14H2,(H2,24,25,27)