1-cycloheptyl-3-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]urea

Systemtic Name: 1-cycloheptyl-3-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]urea Openeye Name: 1-cycloheptyl-3-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]urea CAS Name: 1-cycloheptyl-3-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]urea IUPAC Name: 1-cycloheptyl-3-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]urea Traditional Name: 1-cycloheptyl-3-[4-(1,2,4-triazol-1-ylmethyl)benzyl]urea Formula: C18H25N5O MolecularWeight: 327.424

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)NCC2=CC=C(C=C2)CN3C=NC=N3

Isomeric SMILES

C1CCCC(CC1)NC(=O)NCC2=CC=C(C=C2)CN3C=NC=N3

InChI

InChI=1S/C18H25N5O/c24-18(22-17-5-3-1-2-4-6-17)20-11-15-7-9-16(10-8-15)12-23-14-19-13-21-23/h7-10,13-14,17H,1-6,11-12H2,(H2,20,22,24)