3-[3-[(E)-[1-(4-butylphenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]-2,5-dimethyl-pyrrol-1-yl]benzoic acid
Molecular Formula:
C28H27N3O4S
InChI: InChI=1/C28H27N3O4S/c1-4-5-7-19-10-12-22(13-11-19)31-26(33)24(25(32)29-28(31)36)16-21-14-17(2)30(18(21)3)23-9-6-8-20(15-23)27(34)35/h6,8-16H,4-5,7H2,1-3H3,(H,34,35)(H,29,32,36)/b24-16+/f/h29,34H
InChIKey: InChIKey=JUXOEWUQPKOOTE-FBFZCHMRDO
SMILES: CCCCC1=CC=C(C=C1)N2C(=O)C(=CC3=C(N(C(=C3)C)C4=CC=CC(=C4)C(=O)O)C)C(=O)NC2=S
Names:
3-[3-[(E)-[1-(4-butylphenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]-2,5-dimethyl-pyrrol-1-yl]benzoic acid
Registries:
PubChem CID 1728027
PubChem ID 11547763
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