1-[2,4-bis(fluoranyl)phenyl]-3-(6-pyrrolidin-1-ylpyridin-3-yl)thiourea

Systemtic Name: 1-[2,4-bis(fluoranyl)phenyl]-3-(6-pyrrolidin-1-ylpyridin-3-yl)thiourea Openeye Name: 1-(2,4-difluorophenyl)-3-(6-pyrrolidin-1-yl-3-pyridyl)thiourea CAS Name: 1-(2,4-difluorophenyl)-3-[6-(1-pyrrolidinyl)-3-pyridinyl]thiourea IUPAC Name: 1-(2,4-difluorophenyl)-3-(6-pyrrolidin-1-ylpyridin-3-yl)thiourea Traditional Name: 1-(2,4-difluorophenyl)-3-(6-pyrrolidino-3-pyridyl)thiourea Formula: C16H16F2N4S MolecularWeight: 334.386846

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16F2N4S/c17-11-3-5-14(13(18)9-11)21-16(23)20-12-4-6-15(19-10-12)22-7-1-2-8-22/h3-6,9-10H,1-2,7-8H2,(H2,20,21,23)