1-[5-azanyl-3-phenyl-1-[4-(trifluoromethyl)phenyl]pyrazol-4-yl]-3-prop-2-ynyl-urea

Systemtic Name: 1-[5-azanyl-3-phenyl-1-[4-(trifluoromethyl)phenyl]pyrazol-4-yl]-3-prop-2-ynyl-urea Openeye Name: 1-[5-amino-3-phenyl-1-[4-(trifluoromethyl)phenyl]pyrazol-4-yl]-3-prop-2-ynyl-urea CAS Name: 1-[5-amino-3-phenyl-1-[4-(trifluoromethyl)phenyl]-4-pyrazolyl]-3-prop-2-ynylurea IUPAC Name: 1-[5-amino-3-phenyl-1-[4-(trifluoromethyl)phenyl]pyrazol-4-yl]-3-prop-2-ynylurea Traditional Name: 1-[5-amino-3-phenyl-1-[4-(trifluoromethyl)phenyl]pyrazol-4-yl]-3-propargyl-urea Formula: C20H16F3N5O MolecularWeight: 399.36915

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNC(=O)NC1=C(N(N=C1C2=CC=CC=C2)C3=CC=C(C=C3)C(F)(F)F)N

Isomeric SMILES

C#CCNC(=O)NC1=C(N(N=C1C2=CC=CC=C2)C3=CC=C(C=C3)C(F)(F)F)N

InChI

InChI=1S/C20H16F3N5O/c1-2-12-25-19(29)26-17-16(13-6-4-3-5-7-13)27-28(18(17)24)15-10-8-14(9-11-15)20(21,22)23/h1,3-11H,12,24H2,(H2,25,26,29)