1-[3,5-bis[(phenylmethyl)amino]-1,2,4-triazol-1-yl]-2-methyl-propan-1-one

Systemtic Name: 1-[3,5-bis[(phenylmethyl)amino]-1,2,4-triazol-1-yl]-2-methyl-propan-1-one Openeye Name: 1-[3,5-bis(benzylamino)-1,2,4-triazol-1-yl]-2-methyl-propan-1-one CAS Name: 1-[3,5-bis[(phenylmethyl)amino]-1,2,4-triazol-1-yl]-2-methyl-1-propanone IUPAC Name: 1-[3,5-bis(benzylamino)-1,2,4-triazol-1-yl]-2-methylpropan-1-one Traditional Name: 1-[3,5-bis(benzylamino)-1,2,4-triazol-1-yl]-2-methyl-propan-1-one Formula: C20H23N5O MolecularWeight: 349.42952

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1C(=NC(=N1)NCC2=CC=CC=C2)NCC3=CC=CC=C3

Isomeric SMILES

CC(C)C(=O)N1C(=NC(=N1)NCC2=CC=CC=C2)NCC3=CC=CC=C3

InChI

InChI=1S/C20H23N5O/c1-15(2)18(26)25-20(22-14-17-11-7-4-8-12-17)23-19(24-25)21-13-16-9-5-3-6-10-16/h3-12,15H,13-14H2,1-2H3,(H2,21,22,23,24)