5-(3,3-dimethylbutanoylamino)-1-phenethyl-N-phenyl-indole-2-carboxamide

Systemtic Name: 5-(3,3-dimethylbutanoylamino)-1-phenethyl-N-phenyl-indole-2-carboxamide Openeye Name: 5-(3,3-dimethylbutanoylamino)-1-phenethyl-N-phenyl-indole-2-carboxamide CAS Name: 5-[(3,3-dimethyl-1-oxobutyl)amino]-1-phenethyl-N-phenyl-2-indolecarboxamide IUPAC Name: 5-(3,3-dimethylbutanoylamino)-1-phenethyl-N-phenylindole-2-carboxamide Traditional Name: 5-(3,3-dimethylbutanoylamino)-1-phenethyl-N-phenyl-indole-2-carboxamide Formula: C29H31N3O2 MolecularWeight: 453.57534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)NC1=CC2=C(C=C1)N(C(=C2)C(=O)NC3=CC=CC=C3)CCC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)CC(=O)NC1=CC2=C(C=C1)N(C(=C2)C(=O)NC3=CC=CC=C3)CCC4=CC=CC=C4

InChI

InChI=1S/C29H31N3O2/c1-29(2,3)20-27(33)30-24-14-15-25-22(18-24)19-26(28(34)31-23-12-8-5-9-13-23)32(25)17-16-21-10-6-4-7-11-21/h4-15,18-19H,16-17,20H2,1-3H3,(H,30,33)(H,31,34)