9-[(E)-[3-(2-ethylhexyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-3-methyl-8-(phenethylamino)-1,7-diazabicyclo[4.4.0]deca-2,4,6,8-tetraen-10-one
Molecular Formula:
C29H34N4O2S2
InChI: InChI=1/C29H34N4O2S2/c1-4-6-10-21(5-2)19-33-28(35)24(37-29(33)36)17-23-26(30-16-15-22-11-8-7-9-12-22)31-25-14-13-20(3)18-32(25)27(23)34/h7-9,11-14,17-18,21,30H,4-6,10,15-16,19H2,1-3H3/b24-17+
InChIKey: InChIKey=DMNVTAUKHOENJA-JJIBRWJFBR
SMILES: CCCCC(CC)CN1C(=O)C(=CC2=C(N=C3C=CC(=CN3C2=O)C)NCCC4=CC=CC=C4)SC1=S
Names:
9-[(E)-[3-(2-ethylhexyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-3-methyl-8-(phenethylamino)-1,7-diazabicyclo[4.4.0]deca-2,4,6,8-tetraen-10-one
Registries:
PubChem CID 6369135
PubChem ID 11602727
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