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CHEBI:756951 - gcc-4401c

Default Structure
ChEBI IDCHEBI:756951
ChEBI Namegcc-4401c
Stars
Last Modified30 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaCH4O3S.C18H18ClN5O3S
Net Charge0
Average Mass516.001
Monoisotopic Mass515.07000
SMILESCS(=O)(=O)O.O=C(NC[C@H]1CN(c2ccc(N3CCNC=N3)cc2)C(=O)O1)c1ccc(Cl)s1
InChIInChI=1S/C18H18ClN5O3S.CH4O3S/c19-16-6-5-15(28-16)17(25)21-9-14-10-23(18(26)27-14)12-1-3-13(4-2-12)24-8-7-20-11-22-24;1-5(2,3)4/h1-6,11,14H,7-10H2,(H,20,22)(H,21,25);1H3,(H,2,3,4)/t14-;/m0./s1
InChIKeyYSNDMQDQQLSJMR-UQKRIMTDSA-N
ChEBI Ontology
Outgoing Relation(s)
gcc-4401c (CHEBI:756951) is a aromatic amide (CHEBI:62733)
gcc-4401c (CHEBI:756951) is a thiophenes (CHEBI:26961)
Synonym  Source
GCC-4401CChEMBL