1-[5-[(4-chlorophenyl)amino]-3H-1,2,4-triazol-3-yl]-3-propan-2-yl-urea

Systemtic Name: 1-[5-[(4-chlorophenyl)amino]-3H-1,2,4-triazol-3-yl]-3-propan-2-yl-urea Openeye Name: 1-[5-(4-chloroanilino)-3H-1,2,4-triazol-3-yl]-3-isopropyl-urea CAS Name: 1-[5-(4-chloroanilino)-3H-1,2,4-triazol-3-yl]-3-propan-2-ylurea IUPAC Name: 1-[5-(4-chloroanilino)-3H-1,2,4-triazol-3-yl]-3-propan-2-ylurea Traditional Name: 1-[5-(4-chloroanilino)-3H-1,2,4-triazol-3-yl]-3-isopropyl-urea Formula: C12H15ClN6O MolecularWeight: 294.7401

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC1N=C(N=N1)NC2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)NC(=O)NC1N=C(N=N1)NC2=CC=C(C=C2)Cl

InChI

InChI=1S/C12H15ClN6O/c1-7(2)14-12(20)17-11-16-10(18-19-11)15-9-5-3-8(13)4-6-9/h3-7,11H,1-2H3,(H,15,16)(H2,14,17,20)