1-[2,6-di(propan-2-yl)phenyl]-3-(2-ethanoyl-5-tetradecyl-1,2,4-triazol-3-yl)urea

Systemtic Name: 1-[2,6-di(propan-2-yl)phenyl]-3-(2-ethanoyl-5-tetradecyl-1,2,4-triazol-3-yl)urea Openeye Name: 1-(2-acetyl-5-tetradecyl-1,2,4-triazol-3-yl)-3-(2,6-diisopropylphenyl)urea CAS Name: 1-(2-acetyl-5-tetradecyl-1,2,4-triazol-3-yl)-3-[2,6-di(propan-2-yl)phenyl]urea IUPAC Name: 1-(2-acetyl-5-tetradecyl-1,2,4-triazol-3-yl)-3-[2,6-di(propan-2-yl)phenyl]urea Traditional Name: 1-(2-acetyl-5-myristyl-1,2,4-triazol-3-yl)-3-(2,6-diisopropylphenyl)urea Formula: C31H51N5O2 MolecularWeight: 525.76894

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC1=NN(C(=N1)NC(=O)NC2=C(C=CC=C2C(C)C)C(C)C)C(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCC1=NN(C(=N1)NC(=O)NC2=C(C=CC=C2C(C)C)C(C)C)C(=O)C

InChI

InChI=1S/C31H51N5O2/c1-7-8-9-10-11-12-13-14-15-16-17-18-22-28-32-30(36(35-28)25(6)37)34-31(38)33-29-26(23(2)3)20-19-21-27(29)24(4)5/h19-21,23-24H,7-18,22H2,1-6H3,(H2,32,33,34,35,38)