1-[[(1Z)-1-pyrrol-2-ylideneethyl]amino]-3-[3-(trifluoromethyl)phenyl]thiourea

Systemtic Name: 1-[[(1Z)-1-pyrrol-2-ylideneethyl]amino]-3-[3-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-[[(1Z)-1-pyrrol-2-ylideneethyl]amino]-3-[3-(trifluoromethyl)phenyl]thiourea CAS Name: 1-[[(1Z)-1-(2-pyrrolylidene)ethyl]amino]-3-[3-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-[[(1Z)-1-pyrrol-2-ylideneethyl]amino]-3-[3-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-[[(1Z)-1-pyrrol-2-ylideneethyl]amino]-3-[3-(trifluoromethyl)phenyl]thiourea Formula: C14H13F3N4S MolecularWeight: 326.34003

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C=CC=N1)NNC(=S)NC2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

C/C(=C/1\C=CC=N1)/NNC(=S)NC2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C14H13F3N4S/c1-9(12-6-3-7-18-12)20-21-13(22)19-11-5-2-4-10(8-11)14(15,16)17/h2-8,20H,1H3,(H2,19,21,22)/b12-9-