2-[(E)-N-(carbamothioylamino)-C-(9H-fluoren-2-yl)carbonimidoyl]benzoic acid

Systemtic Name: 2-[(E)-N-(carbamothioylamino)-C-(9H-fluoren-2-yl)carbonimidoyl]benzoic acid Openeye Name: 2-[(E)-N-(carbamothioylamino)-C-(9H-fluoren-2-yl)carbonimidoyl]benzoic acid CAS Name: 2-[(E)-(carbamothioylhydrazinylidene)-(9H-fluoren-2-yl)methyl]benzoic acid IUPAC Name: 2-[(E)-N-(carbamothioylamino)-C-(9H-fluoren-2-yl)carbonimidoyl]benzoic acid Traditional Name: 2-[(E)-C-(9H-fluoren-2-yl)-N-thioureido-carbonimidoyl]benzoic acid Formula: C22H17N3O2S MolecularWeight: 387.45428

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C3=C1C=C(C=C3)C(=NNC(=S)N)C4=CC=CC=C4C(=O)O

Isomeric SMILES

C1C2=CC=CC=C2C3=C1C=C(C=C3)/C(=N\NC(=S)N)/C4=CC=CC=C4C(=O)O

InChI

InChI=1S/C22H17N3O2S/c23-22(28)25-24-20(18-7-3-4-8-19(18)21(26)27)14-9-10-17-15(12-14)11-13-5-1-2-6-16(13)17/h1-10,12H,11H2,(H,26,27)(H3,23,25,28)/b24-20+