3-(3H-benzimidazol-5-ylamino)-4-[[1-(3-hydroxyphenyl)cyclopropyl]amino]cyclobut-3-ene-1,2-dione

Systemtic Name: 3-(3H-benzimidazol-5-ylamino)-4-[[1-(3-hydroxyphenyl)cyclopropyl]amino]cyclobut-3-ene-1,2-dione Openeye Name: 3-(3H-benzimidazol-5-ylamino)-4-[[1-(3-hydroxyphenyl)cyclopropyl]amino]cyclobut-3-ene-1,2-dione CAS Name: 3-(3H-benzimidazol-5-ylamino)-4-[[1-(3-hydroxyphenyl)cyclopropyl]amino]cyclobut-3-ene-1,2-dione IUPAC Name: 3-(3H-benzimidazol-5-ylamino)-4-[[1-(3-hydroxyphenyl)cyclopropyl]amino]cyclobut-3-ene-1,2-dione Traditional Name: 3-(3H-benzimidazol-5-ylamino)-4-[[1-(3-hydroxyphenyl)cyclopropyl]amino]cyclobut-3-ene-1,2-quinone Formula: C20H16N4O3 MolecularWeight: 360.36604

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1(C2=CC(=CC=C2)O)NC3=C(C(=O)C3=O)NC4=CC5=C(C=C4)N=CN5

Isomeric SMILES

C1CC1(C2=CC(=CC=C2)O)NC3=C(C(=O)C3=O)NC4=CC5=C(C=C4)N=CN5

InChI

InChI=1S/C20H16N4O3/c25-13-3-1-2-11(8-13)20(6-7-20)24-17-16(18(26)19(17)27)23-12-4-5-14-15(9-12)22-10-21-14/h1-5,8-10,23-25H,6-7H2,(H,21,22)