1-(4-chlorophenyl)-3-[3-(1,2,4-triazol-1-yl)propyl]urea

Systemtic Name: 1-(4-chlorophenyl)-3-[3-(1,2,4-triazol-1-yl)propyl]urea Openeye Name: 1-(4-chlorophenyl)-3-[3-(1,2,4-triazol-1-yl)propyl]urea CAS Name: 1-(4-chlorophenyl)-3-[3-(1,2,4-triazol-1-yl)propyl]urea IUPAC Name: 1-(4-chlorophenyl)-3-[3-(1,2,4-triazol-1-yl)propyl]urea Traditional Name: 1-(4-chlorophenyl)-3-[3-(1,2,4-triazol-1-yl)propyl]urea Formula: C12H14ClN5O MolecularWeight: 279.72546

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)NCCCN2C=NC=N2)Cl

Isomeric SMILES

C1=CC(=CC=C1NC(=O)NCCCN2C=NC=N2)Cl

InChI

InChI=1S/C12H14ClN5O/c13-10-2-4-11(5-3-10)17-12(19)15-6-1-7-18-9-14-8-16-18/h2-5,8-9H,1,6-7H2,(H2,15,17,19)