NCS
China New Chemical Substance Search
CCG-63802
unii-339bu4y35u, hms1804i11, CCG-63802
CAS Number: 620112-78-9
IUPAC name: (E)-2-(1,3-benzothiazol-2-yl)-3-[9-methyl-2-(3-methylphenoxy)-4-oxopyrido[1,2-a]pyrimidin-3-yl]prop-2-enenitrile
Molecular formula: C26H18N4O2S
Molecular weight: 450.51200
InChI: InChI=1S/C26H18N4O2S/c1-16-7-5-9-19(13-16)32-24-20(26(31)30-12-6-8-17(2)23(30)29-24)14-18(15-27)25-28-21-10-3-4-11-22(21)33-25/h3-14H,1-2H3/b18-14+
InChIKey: VFSVKVQMZDJFQX-NBVRZTHBSA-N
SMILES: -
EINECS: CC1=CC(=CC=C1)OC2=C(C(=O)N3C=CC=C(C3=N2)C)/C=C(\C#N)/C4=NC5=CC=CC=C5S4
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