N-carbamimidoyl-N-pyridin-4-yloxy-4-(trifluoromethyl)-1H-indole-2-carboxamide

Systemtic Name: N-carbamimidoyl-N-pyridin-4-yloxy-4-(trifluoromethyl)-1H-indole-2-carboxamide Openeye Name: N-carbamimidoyl-N-(4-pyridyloxy)-4-(trifluoromethyl)-1H-indole-2-carboxamide CAS Name: N-carbamimidoyl-N-pyridin-4-yloxy-4-(trifluoromethyl)-1H-indole-2-carboxamide IUPAC Name: N-carbamimidoyl-N-pyridin-4-yloxy-4-(trifluoromethyl)-1H-indole-2-carboxamide Traditional Name: N-amidino-N-(4-pyridyloxy)-4-(trifluoromethyl)-1H-indole-2-carboxamide Formula: C16H12F3N5O2 MolecularWeight: 363.29399

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C=C(NC2=C1)C(=O)N(C(=N)N)OC3=CC=NC=C3)C(F)(F)F

Isomeric SMILES

C1=CC(=C2C=C(NC2=C1)C(=O)N(C(=N)N)OC3=CC=NC=C3)C(F)(F)F

InChI

InChI=1S/C16H12F3N5O2/c17-16(18,19)11-2-1-3-12-10(11)8-13(23-12)14(25)24(15(20)21)26-9-4-6-22-7-5-9/h1-8,23H,(H3,20,21)