N-(4-aminophenyl)-5-(3,3-dimethylbutanoylamino)-1-phenyl-indole-2-carboxamide

Systemtic Name: N-(4-aminophenyl)-5-(3,3-dimethylbutanoylamino)-1-phenyl-indole-2-carboxamide Openeye Name: N-(4-aminophenyl)-5-(3,3-dimethylbutanoylamino)-1-phenyl-indole-2-carboxamide CAS Name: N-(4-aminophenyl)-5-[(3,3-dimethyl-1-oxobutyl)amino]-1-phenyl-2-indolecarboxamide IUPAC Name: N-(4-aminophenyl)-5-(3,3-dimethylbutanoylamino)-1-phenylindole-2-carboxamide Traditional Name: N-(4-aminophenyl)-5-(3,3-dimethylbutanoylamino)-1-phenyl-indole-2-carboxamide Formula: C27H28N4O2 MolecularWeight: 440.53682

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H28N4O2/c1-27(2,3)17-25(32)29-21-13-14-23-18(15-21)16-24(31(23)22-7-5-4-6-8-22)26(33)30-20-11-9-19(28)10-12-20/h4-16H,17,28H2,1-3H3,(H,29,32)(H,30,33)