3-[[3-[[3-(diazanylmethylideneamino)phenyl]carbonylamino]phenyl]sulfonylamino]pent-4-ynoic acid

Systemtic Name: 3-[[3-[[3-(diazanylmethylideneamino)phenyl]carbonylamino]phenyl]sulfonylamino]pent-4-ynoic acid Openeye Name: 3-[[3-[[3-(hydrazinomethyleneamino)benzoyl]amino]phenyl]sulfonylamino]pent-4-ynoic acid CAS Name: 3-[[3-[[[3-(hydrazinylmethylideneamino)phenyl]-oxomethyl]amino]phenyl]sulfonylamino]-4-pentynoic acid IUPAC Name: 3-[[3-[[3-(hydrazinylmethylideneamino)benzoyl]amino]phenyl]sulfonylamino]pent-4-ynoic acid Traditional Name: 3-[[3-[[3-(hydrazinomethyleneamino)benzoyl]amino]phenyl]sulfonylamino]pent-4-ynoic acid Formula: C19H19N5O5S MolecularWeight: 429.44966

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Descriptors Computed from Structure

Canonical SMILES:

C#CC(CC(=O)O)NS(=O)(=O)C1=CC=CC(=C1)NC(=O)C2=CC(=CC=C2)N=CNN

Isomeric SMILES

C#CC(CC(=O)O)NS(=O)(=O)C1=CC=CC(=C1)NC(=O)C2=CC(=CC=C2)N=CNN

InChI

InChI=1S/C19H19N5O5S/c1-2-14(11-18(25)26)24-30(28,29)17-8-4-7-16(10-17)23-19(27)13-5-3-6-15(9-13)21-12-22-20/h1,3-10,12,14,24H,11,20H2,(H,21,22)(H,23,27)(H,25,26)