N-methyl-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]-9H-xanthene-9-carboxamide

Systemtic Name: N-methyl-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]-9H-xanthene-9-carboxamide Openeye Name: N-methyl-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]-9H-xanthene-9-carboxamide CAS Name: N-methyl-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]-9H-xanthene-9-carboxamide IUPAC Name: N-methyl-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]-9H-xanthene-9-carboxamide Traditional Name: N-methyl-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]-9H-xanthene-9-carboxamide Formula: C25H22N4O2 MolecularWeight: 410.46778

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)N2C=NC=N2)N(C)C(=O)C3C4=CC=CC=C4OC5=CC=CC=C35

Isomeric SMILES

CC(C1=CC=C(C=C1)N2C=NC=N2)N(C)C(=O)C3C4=CC=CC=C4OC5=CC=CC=C35

InChI

InChI=1S/C25H22N4O2/c1-17(18-11-13-19(14-12-18)29-16-26-15-27-29)28(2)25(30)24-20-7-3-5-9-22(20)31-23-10-6-4-8-21(23)24/h3-17,24H,1-2H3