1-cycloheptyl-1-[[4-(1,2,4-triazol-1-yl)phenyl]methyl]-3-(2,4,6-trimethylphenyl)urea

Systemtic Name: 1-cycloheptyl-1-[[4-(1,2,4-triazol-1-yl)phenyl]methyl]-3-(2,4,6-trimethylphenyl)urea Openeye Name: 1-cycloheptyl-1-[[4-(1,2,4-triazol-1-yl)phenyl]methyl]-3-(2,4,6-trimethylphenyl)urea CAS Name: 1-cycloheptyl-1-[[4-(1,2,4-triazol-1-yl)phenyl]methyl]-3-(2,4,6-trimethylphenyl)urea IUPAC Name: 1-cycloheptyl-1-[[4-(1,2,4-triazol-1-yl)phenyl]methyl]-3-(2,4,6-trimethylphenyl)urea Traditional Name: 1-cycloheptyl-3-mesityl-1-[4-(1,2,4-triazol-1-yl)benzyl]urea Formula: C26H33N5O MolecularWeight: 431.57312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)N(CC2=CC=C(C=C2)N3C=NC=N3)C4CCCCCC4)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)N(CC2=CC=C(C=C2)N3C=NC=N3)C4CCCCCC4)C

InChI

InChI=1S/C26H33N5O/c1-19-14-20(2)25(21(3)15-19)29-26(32)30(23-8-6-4-5-7-9-23)16-22-10-12-24(13-11-22)31-18-27-17-28-31/h10-15,17-18,23H,4-9,16H2,1-3H3,(H,29,32)