1-(3-chloranyl-4-fluoranyl-phenyl)-3-(6-pyrrolidin-1-ylpyridin-3-yl)thiourea

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)-3-(6-pyrrolidin-1-ylpyridin-3-yl)thiourea Openeye Name: 1-(3-chloro-4-fluoro-phenyl)-3-(6-pyrrolidin-1-yl-3-pyridyl)thiourea CAS Name: 1-(3-chloro-4-fluorophenyl)-3-[6-(1-pyrrolidinyl)-3-pyridinyl]thiourea IUPAC Name: 1-(3-chloro-4-fluorophenyl)-3-(6-pyrrolidin-1-ylpyridin-3-yl)thiourea Traditional Name: 1-(3-chloro-4-fluoro-phenyl)-3-(6-pyrrolidino-3-pyridyl)thiourea Formula: C16H16ClFN4S MolecularWeight: 350.841443

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC=C(C=C2)NC(=S)NC3=CC(=C(C=C3)F)Cl

Isomeric SMILES

C1CCN(C1)C2=NC=C(C=C2)NC(=S)NC3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C16H16ClFN4S/c17-13-9-11(3-5-14(13)18)20-16(23)21-12-4-6-15(19-10-12)22-7-1-2-8-22/h3-6,9-10H,1-2,7-8H2,(H2,20,21,23)