5-[2-azanyl-5-(ethylcarbamoylamino)phenyl]sulfonyl-2-methyl-benzenesulfonic acid

Systemtic Name: 5-[2-azanyl-5-(ethylcarbamoylamino)phenyl]sulfonyl-2-methyl-benzenesulfonic acid Openeye Name: 5-[2-amino-5-(ethylcarbamoylamino)phenyl]sulfonyl-2-methyl-benzenesulfonic acid CAS Name: 5-[2-amino-5-(ethylcarbamoylamino)phenyl]sulfonyl-2-methylbenzenesulfonic acid IUPAC Name: 5-[2-amino-5-(ethylcarbamoylamino)phenyl]sulfonyl-2-methylbenzenesulfonic acid Traditional Name: 5-[2-amino-5-(ethylcarbamoylamino)phenyl]sulfonyl-2-methyl-besylic acid Formula: C16H19N3O6S2 MolecularWeight: 413.46856

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC1=CC(=C(C=C1)N)S(=O)(=O)C2=CC(=C(C=C2)C)S(=O)(=O)O

Isomeric SMILES

CCNC(=O)NC1=CC(=C(C=C1)N)S(=O)(=O)C2=CC(=C(C=C2)C)S(=O)(=O)O

InChI

InChI=1S/C16H19N3O6S2/c1-3-18-16(20)19-11-5-7-13(17)15(8-11)26(21,22)12-6-4-10(2)14(9-12)27(23,24)25/h4-9H,3,17H2,1-2H3,(H2,18,19,20)(H,23,24,25)