1-prop-2-enyl-3-[2-[3-(trifluoromethyl)phenyl]-3,4-dihydropyrazol-5-yl]thiourea

Systemtic Name: 1-prop-2-enyl-3-[2-[3-(trifluoromethyl)phenyl]-3,4-dihydropyrazol-5-yl]thiourea Openeye Name: 1-allyl-3-[2-[3-(trifluoromethyl)phenyl]-3,4-dihydropyrazol-5-yl]thiourea CAS Name: 1-prop-2-enyl-3-[2-[3-(trifluoromethyl)phenyl]-3,4-dihydropyrazol-5-yl]thiourea IUPAC Name: 1-prop-2-enyl-3-[2-[3-(trifluoromethyl)phenyl]-3,4-dihydropyrazol-5-yl]thiourea Traditional Name: 1-allyl-3-[1-[3-(trifluoromethyl)phenyl]-2-pyrazolin-3-yl]thiourea Formula: C14H15F3N4S MolecularWeight: 328.35591

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=S)NC1=NN(CC1)C2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

C=CCNC(=S)NC1=NN(CC1)C2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C14H15F3N4S/c1-2-7-18-13(22)19-12-6-8-21(20-12)11-5-3-4-10(9-11)14(15,16)17/h2-5,9H,1,6-8H2,(H2,18,19,20,22)