N-carbamimidoyl-2-methyl-N-[4-(1,2,3-triazol-1-yl)phenoxy]-3-(trifluoromethyl)benzamide

Systemtic Name: N-carbamimidoyl-2-methyl-N-[4-(1,2,3-triazol-1-yl)phenoxy]-3-(trifluoromethyl)benzamide Openeye Name: N-carbamimidoyl-2-methyl-N-[4-(triazol-1-yl)phenoxy]-3-(trifluoromethyl)benzamide CAS Name: N-carbamimidoyl-2-methyl-N-[4-(1-triazolyl)phenoxy]-3-(trifluoromethyl)benzamide IUPAC Name: N-carbamimidoyl-2-methyl-N-[4-(triazol-1-yl)phenoxy]-3-(trifluoromethyl)benzamide Traditional Name: N-amidino-2-methyl-N-[4-(triazol-1-yl)phenoxy]-3-(trifluoromethyl)benzamide Formula: C18H15F3N6O2 MolecularWeight: 404.34591

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1C(F)(F)F)C(=O)N(C(=N)N)OC2=CC=C(C=C2)N3C=CN=N3

Isomeric SMILES

CC1=C(C=CC=C1C(F)(F)F)C(=O)N(C(=N)N)OC2=CC=C(C=C2)N3C=CN=N3

InChI

InChI=1S/C18H15F3N6O2/c1-11-14(3-2-4-15(11)18(19,20)21)16(28)27(17(22)23)29-13-7-5-12(6-8-13)26-10-9-24-25-26/h2-10H,1H3,(H3,22,23)