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

Systemtic Name: 1-cyclohexyl-3-[4-(1,2,4-triazol-1-ylmethyl)phenyl]urea Openeye Name: 1-cyclohexyl-3-[4-(1,2,4-triazol-1-ylmethyl)phenyl]urea CAS Name: 1-cyclohexyl-3-[4-(1,2,4-triazol-1-ylmethyl)phenyl]urea IUPAC Name: 1-cyclohexyl-3-[4-(1,2,4-triazol-1-ylmethyl)phenyl]urea Traditional Name: 1-cyclohexyl-3-[4-(1,2,4-triazol-1-ylmethyl)phenyl]urea Formula: C16H21N5O MolecularWeight: 299.37084

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)NC2=CC=C(C=C2)CN3C=NC=N3

Isomeric SMILES

C1CCC(CC1)NC(=O)NC2=CC=C(C=C2)CN3C=NC=N3

InChI

InChI=1S/C16H21N5O/c22-16(19-14-4-2-1-3-5-14)20-15-8-6-13(7-9-15)10-21-12-17-11-18-21/h6-9,11-12,14H,1-5,10H2,(H2,19,20,22)