1-phenethyl-3-[2-[[4-(trifluoromethyl)pyrimidin-2-yl]amino]ethyl]thiourea

Systemtic Name: 1-phenethyl-3-[2-[[4-(trifluoromethyl)pyrimidin-2-yl]amino]ethyl]thiourea Openeye Name: 1-phenethyl-3-[2-[[4-(trifluoromethyl)pyrimidin-2-yl]amino]ethyl]thiourea CAS Name: 1-phenethyl-3-[2-[[4-(trifluoromethyl)-2-pyrimidinyl]amino]ethyl]thiourea IUPAC Name: 1-phenethyl-3-[2-[[4-(trifluoromethyl)pyrimidin-2-yl]amino]ethyl]thiourea Traditional Name: 1-phenethyl-3-[2-[[4-(trifluoromethyl)pyrimidin-2-yl]amino]ethyl]thiourea Formula: C16H18F3N5S MolecularWeight: 369.40783

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=S)NCCNC2=NC=CC(=N2)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=S)NCCNC2=NC=CC(=N2)C(F)(F)F

InChI

InChI=1S/C16H18F3N5S/c17-16(18,19)13-7-9-20-14(24-13)21-10-11-23-15(25)22-8-6-12-4-2-1-3-5-12/h1-5,7,9H,6,8,10-11H2,(H,20,21,24)(H2,22,23,25)