3-[[[2-(3H-benzimidazol-5-ylamino)-3,4-bis(oxidanylidene)cyclobuten-1-yl]amino]methyl]benzenesulfonamide

Systemtic Name: 3-[[[2-(3H-benzimidazol-5-ylamino)-3,4-bis(oxidanylidene)cyclobuten-1-yl]amino]methyl]benzenesulfonamide Openeye Name: 3-[[[2-(3H-benzimidazol-5-ylamino)-3,4-dioxo-cyclobuten-1-yl]amino]methyl]benzenesulfonamide CAS Name: 3-[[[2-(3H-benzimidazol-5-ylamino)-3,4-dioxo-1-cyclobutenyl]amino]methyl]benzenesulfonamide IUPAC Name: 3-[[[2-(3H-benzimidazol-5-ylamino)-3,4-dioxocyclobuten-1-yl]amino]methyl]benzenesulfonamide Traditional Name: 3-[[[2-(3H-benzimidazol-5-ylamino)-3,4-diketo-cyclobuten-1-yl]amino]methyl]benzenesulfonamide Formula: C18H15N5O4S MolecularWeight: 397.4078

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)N)CNC2=C(C(=O)C2=O)NC3=CC4=C(C=C3)N=CN4

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)N)CNC2=C(C(=O)C2=O)NC3=CC4=C(C=C3)N=CN4

InChI

InChI=1S/C18H15N5O4S/c19-28(26,27)12-3-1-2-10(6-12)8-20-15-16(18(25)17(15)24)23-11-4-5-13-14(7-11)22-9-21-13/h1-7,9,20,23H,8H2,(H,21,22)(H2,19,26,27)