N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-6-methyl-quinazoline-2-carboxamide

Systemtic Name: N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-6-methyl-quinazoline-2-carboxamide Openeye Name: N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-6-methyl-quinazoline-2-carboxamide CAS Name: N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-6-methyl-2-quinazolinecarboxamide IUPAC Name: N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-6-methylquinazoline-2-carboxamide Traditional Name: N-[3,5-bis(trifluoromethyl)benzyl]-6-methyl-quinazoline-2-carboxamide Formula: C19H13F6N3O MolecularWeight: 413.316439

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CN=C(N=C2C=C1)C(=O)NCC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CC1=CC2=CN=C(N=C2C=C1)C(=O)NCC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C19H13F6N3O/c1-10-2-3-15-12(4-10)9-26-16(28-15)17(29)27-8-11-5-13(18(20,21)22)7-14(6-11)19(23,24)25/h2-7,9H,8H2,1H3,(H,27,29)