3-(tert-butylamino)-4-(isoquinolin-5-ylamino)cyclobut-3-ene-1,2-dione

Systemtic Name: 3-(tert-butylamino)-4-(isoquinolin-5-ylamino)cyclobut-3-ene-1,2-dione Openeye Name: 3-(tert-butylamino)-4-(5-isoquinolylamino)cyclobut-3-ene-1,2-dione CAS Name: 3-(tert-butylamino)-4-(5-isoquinolinylamino)cyclobut-3-ene-1,2-dione IUPAC Name: 3-(tert-butylamino)-4-(isoquinolin-5-ylamino)cyclobut-3-ene-1,2-dione Traditional Name: 3-(tert-butylamino)-4-(5-isoquinolylamino)cyclobut-3-ene-1,2-quinone Formula: C17H17N3O2 MolecularWeight: 295.33578

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC1=C(C(=O)C1=O)NC2=CC=CC3=C2C=CN=C3

Isomeric SMILES

CC(C)(C)NC1=C(C(=O)C1=O)NC2=CC=CC3=C2C=CN=C3

InChI

InChI=1S/C17H17N3O2/c1-17(2,3)20-14-13(15(21)16(14)22)19-12-6-4-5-10-9-18-8-7-11(10)12/h4-9,19-20H,1-3H3