1-prop-2-enyl-3-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]thiourea

Systemtic Name: 1-prop-2-enyl-3-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-allyl-3-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]thiourea CAS Name: 1-prop-2-enyl-3-[2-(1-pyrazolyl)-5-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-prop-2-enyl-3-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-allyl-3-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]thiourea Formula: C14H13F3N4S MolecularWeight: 326.34003

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=S)NC1=C(C=CC(=C1)C(F)(F)F)N2C=CC=N2

Isomeric SMILES

C=CCNC(=S)NC1=C(C=CC(=C1)C(F)(F)F)N2C=CC=N2

InChI

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