N-[[4-(5-bromanylpyrimidin-2-yl)oxy-3-methyl-phenyl]carbamoyl]-2-(dihexylamino)benzamide

Systemtic Name: N-[[4-(5-bromanylpyrimidin-2-yl)oxy-3-methyl-phenyl]carbamoyl]-2-(dihexylamino)benzamide Openeye Name: N-[[4-(5-bromopyrimidin-2-yl)oxy-3-methyl-phenyl]carbamoyl]-2-(dihexylamino)benzamide CAS Name: N-[[4-[(5-bromo-2-pyrimidinyl)oxy]-3-methylanilino]-oxomethyl]-2-(dihexylamino)benzamide IUPAC Name: N-[[4-(5-bromopyrimidin-2-yl)oxy-3-methylphenyl]carbamoyl]-2-(dihexylamino)benzamide Traditional Name: N-[[4-(5-bromopyrimidin-2-yl)oxy-3-methyl-phenyl]carbamoyl]-2-(dihexylamino)benzamide Formula: C31H40BrN5O3 MolecularWeight: 610.585

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(CCCCCC)C1=CC=CC=C1C(=O)NC(=O)NC2=CC(=C(C=C2)OC3=NC=C(C=N3)Br)C

Isomeric SMILES

CCCCCCN(CCCCCC)C1=CC=CC=C1C(=O)NC(=O)NC2=CC(=C(C=C2)OC3=NC=C(C=N3)Br)C

InChI

InChI=1S/C31H40BrN5O3/c1-4-6-8-12-18-37(19-13-9-7-5-2)27-15-11-10-14-26(27)29(38)36-30(39)35-25-16-17-28(23(3)20-25)40-31-33-21-24(32)22-34-31/h10-11,14-17,20-22H,4-9,12-13,18-19H2,1-3H3,(H2,35,36,38,39)