IUPAC: 1-(3-cyanophenyl)-3-[4-[(4-sulfamoylphenyl)methylsulfamoyl]phenyl]urea
SMILES:
N#Cc1cccc(NC(=O)Nc2ccc(S(=O)(=O)NCc3ccc(S(N)(=O)=O)cc3)cc2)c1Canonical SMILES:
C1=CC(=CC(=C1)NC(=O)NC2=CC=C(C=C2)S(=O)(=O)NCC3=CC=C(C=C3)S(=O)(=O)N)C#N분자식: C21H19N5O5S2
분자량: 485.50
InChIKey: IDVYPWBAOMBNQY-UHFFFAOYSA-N
InChI:
PubChem CID: 57496180 →InChI=1S/C21H19N5O5S2/c22-13-16-2-1-3-18(12-16)26-21(27)25-17-6-10-20(11-7-17)33(30,31)24-14-15-4-8-19(9-5-15)32(23,28)29/h1-12,24H,14H2,(H2,23,28,29)(H2,25,26,27)동의어
4-(3-(3-cyanophenyl)ureido)-N-(4-sulfamoylbenzyl)benzenesulfonamideSCHEMBL2762150IDVYPWBAOMBNQY-UHFFFAOYSA-N