1-[(4-pyrrol-1-ylphenyl)carbonylamino]-3-[2-(trifluoromethyl)phenyl]thiourea

Systemtic Name: 1-[(4-pyrrol-1-ylphenyl)carbonylamino]-3-[2-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-[(4-pyrrol-1-ylbenzoyl)amino]-3-[2-(trifluoromethyl)phenyl]thiourea CAS Name: 1-[[oxo-[4-(1-pyrrolyl)phenyl]methyl]amino]-3-[2-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-[(4-pyrrol-1-ylbenzoyl)amino]-3-[2-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-[(4-pyrrol-1-ylbenzoyl)amino]-3-[2-(trifluoromethyl)phenyl]thiourea Formula: C19H15F3N4OS MolecularWeight: 404.40881

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(F)(F)F)NC(=S)NNC(=O)C2=CC=C(C=C2)N3C=CC=C3

Isomeric SMILES

C1=CC=C(C(=C1)C(F)(F)F)NC(=S)NNC(=O)C2=CC=C(C=C2)N3C=CC=C3

InChI

InChI=1S/C19H15F3N4OS/c20-19(21,22)15-5-1-2-6-16(15)23-18(28)25-24-17(27)13-7-9-14(10-8-13)26-11-3-4-12-26/h1-12H,(H,24,27)(H2,23,25,28)