3-(3,3-dimethylbutan-2-ylamino)-4-[(4-imidazol-1-ylphenyl)amino]cyclobut-3-ene-1,2-dione

Systemtic Name: 3-(3,3-dimethylbutan-2-ylamino)-4-[(4-imidazol-1-ylphenyl)amino]cyclobut-3-ene-1,2-dione Openeye Name: 3-(4-imidazol-1-ylanilino)-4-(1,2,2-trimethylpropylamino)cyclobut-3-ene-1,2-dione CAS Name: 3-(3,3-dimethylbutan-2-ylamino)-4-[4-(1-imidazolyl)anilino]cyclobut-3-ene-1,2-dione IUPAC Name: 3-(3,3-dimethylbutan-2-ylamino)-4-(4-imidazol-1-ylanilino)cyclobut-3-ene-1,2-dione Traditional Name: 3-(4-imidazol-1-ylanilino)-4-(1,2,2-trimethylpropylamino)cyclobut-3-ene-1,2-quinone Formula: C19H22N4O2 MolecularWeight: 338.40358

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C)(C)C)NC1=C(C(=O)C1=O)NC2=CC=C(C=C2)N3C=CN=C3

Isomeric SMILES

CC(C(C)(C)C)NC1=C(C(=O)C1=O)NC2=CC=C(C=C2)N3C=CN=C3

InChI

InChI=1S/C19H22N4O2/c1-12(19(2,3)4)21-15-16(18(25)17(15)24)22-13-5-7-14(8-6-13)23-10-9-20-11-23/h5-12,21-22H,1-4H3