N-[2-[2-methylheptan-2-yl-[(phenylmethyl)carbamoyl]amino]phenyl]-N-(3-pent-2-ynoxyphenyl)ethanamide

Systemtic Name: N-[2-[2-methylheptan-2-yl-[(phenylmethyl)carbamoyl]amino]phenyl]-N-(3-pent-2-ynoxyphenyl)ethanamide Openeye Name: N-[2-[benzylcarbamoyl(1,1-dimethylhexyl)amino]phenyl]-N-(3-pent-2-ynoxyphenyl)acetamide CAS Name: N-[2-[2-methylheptan-2-yl-[oxo-[(phenylmethyl)amino]methyl]amino]phenyl]-N-(3-pent-2-ynoxyphenyl)acetamide IUPAC Name: N-[2-[benzylcarbamoyl(2-methylheptan-2-yl)amino]phenyl]-N-(3-pent-2-ynoxyphenyl)acetamide Traditional Name: N-[2-[benzylcarbamoyl(1,1-dimethylhexyl)amino]phenyl]-N-(3-pent-2-ynoxyphenyl)acetamide Formula: C35H43N3O3 MolecularWeight: 553.73422

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)(C)N(C1=CC=CC=C1N(C2=CC(=CC=C2)OCC#CCC)C(=O)C)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

CCCCCC(C)(C)N(C1=CC=CC=C1N(C2=CC(=CC=C2)OCC#CCC)C(=O)C)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C35H43N3O3/c1-6-8-15-24-35(4,5)38(34(40)36-27-29-18-11-10-12-19-29)33-23-14-13-22-32(33)37(28(3)39)30-20-17-21-31(26-30)41-25-16-9-7-2/h10-14,17-23,26H,6-8,15,24-25,27H2,1-5H3,(H,36,40)