1-[(4-methoxyphenyl)methyl]-3-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylmethyl)urea

Systemtic Name: 1-[(4-methoxyphenyl)methyl]-3-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylmethyl)urea Openeye Name: 1-[(4-methoxyphenyl)methyl]-3-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylmethyl)urea CAS Name: 1-[(4-methoxyphenyl)methyl]-3-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylmethyl)urea IUPAC Name: 1-[(4-methoxyphenyl)methyl]-3-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylmethyl)urea Traditional Name: 1-p-anisyl-3-(6,7,8,9-tetrahydro-5H-[1,2,4]triazol[4,3-a]azepin-3-ylmethyl)urea Formula: C17H23N5O2 MolecularWeight: 329.39682

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=O)NCC2=NN=C3N2CCCCC3

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=O)NCC2=NN=C3N2CCCCC3

InChI

InChI=1S/C17H23N5O2/c1-24-14-8-6-13(7-9-14)11-18-17(23)19-12-16-21-20-15-5-3-2-4-10-22(15)16/h6-9H,2-5,10-12H2,1H3,(H2,18,19,23)