phenylsulfonylamino 2-[[3-[[3-[bis(azanyl)methylideneamino]phenyl]carbonylamino]phenyl]methyl]butanoate

Systemtic Name: phenylsulfonylamino 2-[[3-[[3-[bis(azanyl)methylideneamino]phenyl]carbonylamino]phenyl]methyl]butanoate Openeye Name: benzenesulfonamido 2-[[3-[(3-guanidinobenzoyl)amino]phenyl]methyl]butanoate CAS Name: 2-[[3-[[[3-(diaminomethylideneamino)phenyl]-oxomethyl]amino]phenyl]methyl]butanoic acid benzenesulfonamido ester IUPAC Name: benzenesulfonamido 2-[[3-[[3-(diaminomethylideneamino)benzoyl]amino]phenyl]methyl]butanoate Traditional Name: 2-[3-[(3-guanidinobenzoyl)amino]benzyl]butyric acid benzenesulfonamido ester Formula: C25H27N5O5S MolecularWeight: 509.57738

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=CC(=CC=C1)NC(=O)C2=CC(=CC=C2)N=C(N)N)C(=O)ONS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCC(CC1=CC(=CC=C1)NC(=O)C2=CC(=CC=C2)N=C(N)N)C(=O)ONS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C25H27N5O5S/c1-2-18(24(32)35-30-36(33,34)22-12-4-3-5-13-22)14-17-8-6-10-20(15-17)28-23(31)19-9-7-11-21(16-19)29-25(26)27/h3-13,15-16,18,30H,2,14H2,1H3,(H,28,31)(H4,26,27,29)