1-[3,5-bis(trifluoromethyl)phenyl]-3-(1H-pyrrol-2-ylcarbonylamino)thiourea

Systemtic Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-(1H-pyrrol-2-ylcarbonylamino)thiourea Openeye Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-(1H-pyrrole-2-carbonylamino)thiourea CAS Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-[[oxo(1H-pyrrol-2-yl)methyl]amino]thiourea IUPAC Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-(1H-pyrrole-2-carbonylamino)thiourea Traditional Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-(1H-pyrrole-2-carbonylamino)thiourea Formula: C14H10F6N4OS MolecularWeight: 396.310819

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Descriptors Computed from Structure

Canonical SMILES:

C1=CNC(=C1)C(=O)NNC(=S)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1=CNC(=C1)C(=O)NNC(=S)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C14H10F6N4OS/c15-13(16,17)7-4-8(14(18,19)20)6-9(5-7)22-12(26)24-23-11(25)10-2-1-3-21-10/h1-6,21H,(H,23,25)(H2,22,24,26)