5-azanyl-2-[3-(tert-butylamino)-2-oxidanyl-propoxy]-N-(1H-indol-4-yl)benzamide

Systemtic Name: 5-azanyl-2-[3-(tert-butylamino)-2-oxidanyl-propoxy]-N-(1H-indol-4-yl)benzamide Openeye Name: 5-amino-2-[3-(tert-butylamino)-2-hydroxy-propoxy]-N-(1H-indol-4-yl)benzamide CAS Name: 5-amino-2-[3-(tert-butylamino)-2-hydroxypropoxy]-N-(1H-indol-4-yl)benzamide IUPAC Name: 5-amino-2-[3-(tert-butylamino)-2-hydroxypropoxy]-N-(1H-indol-4-yl)benzamide Traditional Name: 5-amino-2-[3-(tert-butylamino)-2-hydroxy-propoxy]-N-(1H-indol-4-yl)benzamide Formula: C22H28N4O3 MolecularWeight: 396.48272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCC(COC1=C(C=C(C=C1)N)C(=O)NC2=CC=CC3=C2C=CN3)O

Isomeric SMILES

CC(C)(C)NCC(COC1=C(C=C(C=C1)N)C(=O)NC2=CC=CC3=C2C=CN3)O

InChI

InChI=1S/C22H28N4O3/c1-22(2,3)25-12-15(27)13-29-20-8-7-14(23)11-17(20)21(28)26-19-6-4-5-18-16(19)9-10-24-18/h4-11,15,24-25,27H,12-13,23H2,1-3H3,(H,26,28)